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

Systemtic Name: [(3aS,8bR)-2-cyclohexyl-8b-ethoxycarbonyl-4-methyl-3-oxidanylidene-1H-pyrrolo[3,4-b]indol-3a-yl]azanium Openeye Name: [(3aS,8bR)-2-cyclohexyl-8b-ethoxycarbonyl-4-methyl-3-oxo-1H-pyrrolo[3,4-b]indol-3a-yl]ammonium CAS Name: [(3aS,8bR)-2-cyclohexyl-8b-ethoxycarbonyl-4-methyl-3-oxo-1H-pyrrolo[3,4-b]indol-3a-yl]ammonium IUPAC Name: [(3aS,8bR)-2-cyclohexyl-8b-ethoxycarbonyl-4-methyl-3-oxo-1H-pyrrolo[3,4-b]indol-3a-yl]azanium Traditional Name: [(3aS,8bR)-8b-carbethoxy-2-cyclohexyl-3-keto-4-methyl-1H-pyrrol[3,4-b]indol-3a-yl]ammonium Formula: C20H28N3O3+ MolecularWeight: 358.45462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CN(C(=O)C1(N(C3=CC=CC=C23)C)[NH3+])C4CCCCC4

Isomeric SMILES

CCOC(=O)[C@]12CN(C(=O)[C@]1(N(C3=CC=CC=C23)C)[NH3+])C4CCCCC4

InChI

InChI=1S/C20H27N3O3/c1-3-26-18(25)19-13-23(14-9-5-4-6-10-14)17(24)20(19,21)22(2)16-12-8-7-11-15(16)19/h7-8,11-12,14H,3-6,9-10,13,21H2,1-2H3/p+1/t19-,20-/m1/s1