methyl 2-(3-methoxy-3-oxidanylidene-propyl)-1-methyl-9-(phenylmethyl)-3,4-dihydropyrido[3,4-b]indole-1-carboxylate

Systemtic Name: methyl 2-(3-methoxy-3-oxidanylidene-propyl)-1-methyl-9-(phenylmethyl)-3,4-dihydropyrido[3,4-b]indole-1-carboxylate Openeye Name: methyl 9-benzyl-2-(3-methoxy-3-oxo-propyl)-1-methyl-3,4-dihydropyrido[3,4-b]indole-1-carboxylate CAS Name: 2-(3-methoxy-3-oxopropyl)-1-methyl-9-(phenylmethyl)-3,4-dihydropyrido[3,4-b]indole-1-carboxylic acid methyl ester IUPAC Name: methyl 9-benzyl-2-(3-methoxy-3-oxopropyl)-1-methyl-3,4-dihydropyrido[3,4-b]indole-1-carboxylate Traditional Name: 9-benzyl-2-(3-keto-3-methoxy-propyl)-1-methyl-3,4-dihydro-$b-carboline-1-carboxylic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(CCN1CCC(=O)OC)C3=CC=CC=C3N2CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1(C2=C(CCN1CCC(=O)OC)C3=CC=CC=C3N2CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H28N2O4/c1-25(24(29)31-3)23-20(13-15-26(25)16-14-22(28)30-2)19-11-7-8-12-21(19)27(23)17-18-9-5-4-6-10-18/h4-12H,13-17H2,1-3H3