dimethyl (E)-2-ethanoyl-3-[(phenylmethyl)amino]pent-2-enedioate

Systemtic Name: dimethyl (E)-2-ethanoyl-3-[(phenylmethyl)amino]pent-2-enedioate Openeye Name: dimethyl (E)-2-acetyl-3-(benzylamino)pent-2-enedioate CAS Name: (E)-2-acetyl-3-[(phenylmethyl)amino]-2-pentenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-acetyl-3-(benzylamino)pent-2-enedioate Traditional Name: (E)-2-acetyl-3-(benzylamino)pent-2-enedioic acid dimethyl ester Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(CC(=O)OC)NCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(=O)/C(=C(/CC(=O)OC)\NCC1=CC=CC=C1)/C(=O)OC

InChI

InChI=1S/C16H19NO5/c1-11(18)15(16(20)22-3)13(9-14(19)21-2)17-10-12-7-5-4-6-8-12/h4-8,17H,9-10H2,1-3H3/b15-13+