N-Octylnortadalafil

CAS Registry Number®

1173706-35-8

CAS Name

N-Octylnortadalafil

Molecular Formula

C29H33N3O4

Molecular Mass

487.59

Cite this Page

N-Octylnortadalafil.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1173706-35-8 (retrieved 2024-11-22) (CAS RN: 1173706-35-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H33N3O4/c1-2-3-4-5-6-9-14-31-17-26(33)32-23(29(31)34)16-21-20-10-7-8-11-22(20)30-27(21)28(32)19-12-13-24-25(15-19)36-18-35-24/h7-8,10-13,15,23,28,30H,2-6,9,14,16-18H2,1H3/t23-,28-/m1/s1

InChIKey

InChIKey=JIMWYJMUPCVOFA-QDPGVEIFSA-N

SMILES

O=C1N2[C@@H](C3=C(C=4C(N3)=CC=CC4)C[C@@]2(C(=O)N(CCCCCCCC)C1)[H])C=5C=C6C(=CC5)OCO6

Canonical SMILES

O=C1N2C(C3=CC=C4OCOC4=C3)C=5NC=6C=CC=CC6C5CC2C(=O)N(C1)CCCCCCCC

Other Names for this Substance

  • Pyrazino[1′,2′:1,6]pyrido[3,4-b]indole-1,4-dione, 6-(1,3-benzodioxol-5-yl)-2,3,6,7,12,12a-hexahydro-2-octyl-, (6R,12aR)-
  • (6R,12aR)-6-(1,3-Benzodioxol-5-yl)-2,3,6,7,12,12a-hexahydro-2-octylpyrazino[1′,2′:1,6]pyrido[3,4-b]indole-1,4-dione
  • N-Octylnortadalafil
  • N-Octyltadalafil

CAS INSIGHTSTM
Targeted protein degrader structure, illustration