ethyl 1-(2-ethoxy-2-oxidanylidene-ethyl)-2-(phenylmethyl)-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate

Systemtic Name: ethyl 1-(2-ethoxy-2-oxidanylidene-ethyl)-2-(phenylmethyl)-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate Openeye Name: ethyl 2-benzyl-1-(2-ethoxy-2-oxo-ethyl)-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate CAS Name: 1-(2-ethoxy-2-oxoethyl)-2-(phenylmethyl)-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzyl-1-(2-ethoxy-2-oxoethyl)-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate Traditional Name: 2-benzyl-1-(2-ethoxy-2-keto-ethyl)-4,9-dihydro-3H-$b-carboline-1-carboxylic acid ethyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(C2=C(CCN1CC3=CC=CC=C3)C4=CC=CC=C4N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1(C2=C(CCN1CC3=CC=CC=C3)C4=CC=CC=C4N2)C(=O)OCC

InChI

InChI=1S/C25H28N2O4/c1-3-30-22(28)16-25(24(29)31-4-2)23-20(19-12-8-9-13-21(19)26-23)14-15-27(25)17-18-10-6-5-7-11-18/h5-13,26H,3-4,14-17H2,1-2H3