(phenylmethyl) 3-(3-ethoxy-3-oxidanylidene-propyl)-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: (phenylmethyl) 3-(3-ethoxy-3-oxidanylidene-propyl)-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: benzyl 3-(3-ethoxy-3-oxo-propyl)-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: 3-(3-ethoxy-3-oxopropyl)-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(3-ethoxy-3-oxopropyl)-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: 3-(3-ethoxy-3-keto-propyl)-4-keto-1,5,6,7-tetrahydroindole-2-carboxylic acid benzyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(NC2=C1C(=O)CCC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCC1=C(NC2=C1C(=O)CCC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H23NO5/c1-2-26-18(24)12-11-15-19-16(9-6-10-17(19)23)22-20(15)21(25)27-13-14-7-4-3-5-8-14/h3-5,7-8,22H,2,6,9-13H2,1H3