(8bR)-7-methoxy-3,3,8b-trimethyl-4-(phenylmethyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-3-ium

Systemtic Name: (8bR)-7-methoxy-3,3,8b-trimethyl-4-(phenylmethyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-3-ium Openeye Name: (8bR)-4-benzyl-7-methoxy-3,3,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-3-ium CAS Name: (8bR)-7-methoxy-3,3,8b-trimethyl-4-(phenylmethyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-3-ium IUPAC Name: (8bR)-4-benzyl-7-methoxy-3,3,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-3-ium Traditional Name: (8bR)-4-benzyl-7-methoxy-3,3,8b-trimethyl-2,3a-dihydro-1H-pyrrol[2,3-b]indol-3-ium Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC[N+](C1N(C3=C2C=C(C=C3)OC)CC4=CC=CC=C4)(C)C

Isomeric SMILES

C[C@]12CC[N+](C1N(C3=C2C=C(C=C3)OC)CC4=CC=CC=C4)(C)C

InChI

InChI=1S/C21H27N2O/c1-21-12-13-23(2,3)20(21)22(15-16-8-6-5-7-9-16)19-11-10-17(24-4)14-18(19)21/h5-11,14,20H,12-13,15H2,1-4H3/q+1/t20?,21-/m1/s1