6-methoxy-1-(4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium ethanoate

Systemtic Name: 6-methoxy-1-(4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium ethanoate Openeye Name: 6-methoxy-1-(4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium acetate CAS Name: 6-methoxy-1-(4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium acetate IUPAC Name: 6-methoxy-1-(4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium acetate Traditional Name: 6-methoxy-1-(4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium acetate Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].COC1=CC=C(C=C1)C2C3=C(CC[NH2+]2)C4=C(N3)C=CC(=C4)OC

Isomeric SMILES

CC(=O)[O-].COC1=CC=C(C=C1)C2C3=C(CC[NH2+]2)C4=C(N3)C=CC(=C4)OC

InChI

InChI=1S/C19H20N2O2.C2H4O2/c1-22-13-5-3-12(4-6-13)18-19-15(9-10-20-18)16-11-14(23-2)7-8-17(16)21-19;1-2(3)4/h3-8,11,18,20-21H,9-10H2,1-2H3;1H3,(H,3,4)