methyl 1-(dimethoxymethyl)-9-[(E)-2-methoxycarbonyl-3-phenyl-prop-2-enyl]pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 1-(dimethoxymethyl)-9-[(E)-2-methoxycarbonyl-3-phenyl-prop-2-enyl]pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-(dimethoxymethyl)-9-[(E)-2-methoxycarbonyl-3-phenyl-allyl]pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(dimethoxymethyl)-9-[(E)-2-methoxycarbonyl-3-phenylprop-2-enyl]-3-pyrido[3,4-b]indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(dimethoxymethyl)-9-[(E)-2-methoxycarbonyl-3-phenylprop-2-enyl]pyrido[3,4-b]indole-3-carboxylate Traditional Name: 9-[(E)-2-carbomethoxy-3-phenyl-allyl]-1-(dimethoxymethyl)-$b-carboline-3-carboxylic acid methyl ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=C2C(=CC(=N1)C(=O)OC)C3=CC=CC=C3N2CC(=CC4=CC=CC=C4)C(=O)OC)OC

Isomeric SMILES

COC(C1=C2C(=CC(=N1)C(=O)OC)C3=CC=CC=C3N2C/C(=C\C4=CC=CC=C4)/C(=O)OC)OC

InChI

InChI=1S/C27H26N2O6/c1-32-25(30)18(14-17-10-6-5-7-11-17)16-29-22-13-9-8-12-19(22)20-15-21(26(31)33-2)28-23(24(20)29)27(34-3)35-4/h5-15,27H,16H2,1-4H3/b18-14+