methyl [1-oxidanylidene-3-phenyl-9-(phenylmethyl)-2-prop-2-enyl-pyrido[3,4-b]indol-8-yl] carbonate

Systemtic Name: methyl [1-oxidanylidene-3-phenyl-9-(phenylmethyl)-2-prop-2-enyl-pyrido[3,4-b]indol-8-yl] carbonate Openeye Name: (2-allyl-9-benzyl-1-oxo-3-phenyl-pyrido[3,4-b]indol-8-yl) methyl carbonate CAS Name: carbonic acid methyl [1-oxo-3-phenyl-9-(phenylmethyl)-2-prop-2-enyl-8-pyrido[3,4-b]indolyl] ester IUPAC Name: (9-benzyl-1-oxo-3-phenyl-2-prop-2-enylpyrido[3,4-b]indol-8-yl) methyl carbonate Traditional Name: carbonic acid (2-allyl-9-benzyl-1-keto-3-phenyl-$b-carbolin-8-yl) methyl ester Formula: C29H24N2O4 MolecularWeight: 464.51186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1=CC=CC2=C1N(C3=C2C=C(N(C3=O)CC=C)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

COC(=O)OC1=CC=CC2=C1N(C3=C2C=C(N(C3=O)CC=C)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O4/c1-3-17-30-24(21-13-8-5-9-14-21)18-23-22-15-10-16-25(35-29(33)34-2)26(22)31(27(23)28(30)32)19-20-11-6-4-7-12-20/h3-16,18H,1,17,19H2,2H3