diethyl 2-(3,4-dihydro-2H-pyrido[3,4-b]indol-1-yl)propanedioate

Systemtic Name: diethyl 2-(3,4-dihydro-2H-pyrido[3,4-b]indol-1-yl)propanedioate Openeye Name: diethyl 2-(3,4-dihydro-2H-pyrido[3,4-b]indol-1-yl)propanedioate CAS Name: 2-(3,4-dihydro-2H-pyrido[3,4-b]indol-1-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3,4-dihydro-2H-pyrido[3,4-b]indol-1-yl)propanedioate Traditional Name: 2-(3,4-dihydro-2H-$b-carbolin-1-yl)malonic acid diethyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C2C(=C3C=CC=CC3=N2)CCN1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C2C(=C3C=CC=CC3=N2)CCN1)C(=O)OCC

InChI

InChI=1S/C18H20N2O4/c1-3-23-17(21)14(18(22)24-4-2)16-15-12(9-10-19-16)11-7-5-6-8-13(11)20-15/h5-8,14,19H,3-4,9-10H2,1-2H3