diethyl (Z)-2-ethanoyl-3-[(phenylmethyl)amino]pent-2-enedioate

Systemtic Name: diethyl (Z)-2-ethanoyl-3-[(phenylmethyl)amino]pent-2-enedioate Openeye Name: diethyl (Z)-2-acetyl-3-(benzylamino)pent-2-enedioate CAS Name: (Z)-2-acetyl-3-[(phenylmethyl)amino]-2-pentenedioic acid diethyl ester IUPAC Name: diethyl (Z)-2-acetyl-3-(benzylamino)pent-2-enedioate Traditional Name: (Z)-2-acetyl-3-(benzylamino)pent-2-enedioic acid diethyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=C(C(=O)C)C(=O)OCC)NCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C/C(=C(\C(=O)C)/C(=O)OCC)/NCC1=CC=CC=C1

InChI

InChI=1S/C18H23NO5/c1-4-23-16(21)11-15(17(13(3)20)18(22)24-5-2)19-12-14-9-7-6-8-10-14/h6-10,19H,4-5,11-12H2,1-3H3/b17-15-