(3,4-dimethoxyphenyl)methyl-[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[(1S)-2-[(9-ethylcarbazol-3-yl)amino]-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[(2S)-1-[(9-ethyl-3-carbazolyl)amino]-1-oxopropan-2-yl]-methylammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxopropan-2-yl]-methylazanium Traditional Name: [(1S)-2-[(9-ethylcarbazol-3-yl)amino]-2-keto-1-methyl-ethyl]-methyl-veratryl-ammonium Formula: C27H32N3O3+ MolecularWeight: 446.56128

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)[NH+](C)CC3=CC(=C(C=C3)OC)OC)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)[C@H](C)[NH+](C)CC3=CC(=C(C=C3)OC)OC)C4=CC=CC=C41

InChI

InChI=1S/C27H31N3O3/c1-6-30-23-10-8-7-9-21(23)22-16-20(12-13-24(22)30)28-27(31)18(2)29(3)17-19-11-14-25(32-4)26(15-19)33-5/h7-16,18H,6,17H2,1-5H3,(H,28,31)/p+1/t18-/m0/s1