2-[(3-bromanyl-4-methoxy-phenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium

Systemtic Name: 2-[(3-bromanyl-4-methoxy-phenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Openeye Name: 2-[(3-bromo-4-methoxy-phenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium CAS Name: 2-[(3-bromo-4-methoxyphenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium IUPAC Name: 2-[(3-bromo-4-methoxyphenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Traditional Name: 2-(3-bromo-4-methoxy-benzyl)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium Formula: C19H20BrN2O+ MolecularWeight: 372.2789

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCC3=C(C2)NC4=CC=CC=C34)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCC3=C(C2)NC4=CC=CC=C34)Br

InChI

InChI=1S/C19H19BrN2O/c1-23-19-7-6-13(10-16(19)20)11-22-9-8-15-14-4-2-3-5-17(14)21-18(15)12-22/h2-7,10,21H,8-9,11-12H2,1H3/p+1