1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium Traditional Name: 6-methoxy-1-methyl-1-veratryl-2,3,4,9-tetrahydro-$b-carbolin-2-ium Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(CC[NH2+]1)C3=C(N2)C=CC(=C3)OC)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1(C2=C(CC[NH2+]1)C3=C(N2)C=CC(=C3)OC)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C22H26N2O3/c1-22(13-14-5-8-19(26-3)20(11-14)27-4)21-16(9-10-23-22)17-12-15(25-2)6-7-18(17)24-21/h5-8,11-12,23-24H,9-10,13H2,1-4H3/p+1