6-methoxy-1-(3-methoxy-4-propan-2-yloxy-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium

Systemtic Name: 6-methoxy-1-(3-methoxy-4-propan-2-yloxy-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Openeye Name: 1-(4-isopropoxy-3-methoxy-phenyl)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium CAS Name: 6-methoxy-1-(3-methoxy-4-propan-2-yloxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium IUPAC Name: 6-methoxy-1-(3-methoxy-4-propan-2-yloxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Traditional Name: 1-(4-isopropoxy-3-methoxy-phenyl)-6-methoxy-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2C3=C(CC[NH2+]2)C4=C(N3)C=CC(=C4)OC)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2C3=C(CC[NH2+]2)C4=C(N3)C=CC(=C4)OC)OC

InChI

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