[(3aS,8bR)-2-cyclohexyl-6-methoxy-4-methyl-3-oxidanylidene-8b-(phenylmethyl)-1H-pyrrolo[3,4-b]indol-3a-yl]azanium

Systemtic Name: [(3aS,8bR)-2-cyclohexyl-6-methoxy-4-methyl-3-oxidanylidene-8b-(phenylmethyl)-1H-pyrrolo[3,4-b]indol-3a-yl]azanium Openeye Name: [(3aS,8bR)-8b-benzyl-2-cyclohexyl-6-methoxy-4-methyl-3-oxo-1H-pyrrolo[3,4-b]indol-3a-yl]ammonium CAS Name: [(3aS,8bR)-2-cyclohexyl-6-methoxy-4-methyl-3-oxo-8b-(phenylmethyl)-1H-pyrrolo[3,4-b]indol-3a-yl]ammonium IUPAC Name: [(3aS,8bR)-8b-benzyl-2-cyclohexyl-6-methoxy-4-methyl-3-oxo-1H-pyrrolo[3,4-b]indol-3a-yl]azanium Traditional Name: [(3aS,8bR)-8b-benzyl-2-cyclohexyl-3-keto-6-methoxy-4-methyl-1H-pyrrol[3,4-b]indol-3a-yl]ammonium Formula: C25H32N3O2+ MolecularWeight: 406.54048

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)OC)C3(C1(C(=O)N(C3)C4CCCCC4)[NH3+])CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=CC(=C2)OC)[C@]3([C@]1(C(=O)N(C3)C4CCCCC4)[NH3+])CC5=CC=CC=C5

InChI

InChI=1S/C25H31N3O2/c1-27-22-15-20(30-2)13-14-21(22)24(16-18-9-5-3-6-10-18)17-28(23(29)25(24,27)26)19-11-7-4-8-12-19/h3,5-6,9-10,13-15,19H,4,7-8,11-12,16-17,26H2,1-2H3/p+1/t24-,25+/m0/s1