O1-ethyl O5-methyl (Z)-2-ethanoyl-4-methyl-3-[(phenylmethyl)amino]pent-2-enedioate

Systemtic Name: O1-ethyl O5-methyl (Z)-2-ethanoyl-4-methyl-3-[(phenylmethyl)amino]pent-2-enedioate Openeye Name: O1-ethyl O5-methyl (Z)-2-acetyl-3-(benzylamino)-4-methyl-pent-2-enedioate CAS Name: (Z)-2-acetyl-4-methyl-3-[(phenylmethyl)amino]-2-pentenedioic acid O1-ethyl ester O5-methyl ester IUPAC Name: 1-O-ethyl 5-O-methyl (Z)-2-acetyl-3-(benzylamino)-4-methylpent-2-enedioate Traditional Name: (Z)-2-acetyl-3-(benzylamino)-4-methyl-pent-2-enedioic acid O1-ethyl ester O5-methyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO5/c1-5-24-18(22)15(13(3)20)16(12(2)17(21)23-4)19-11-14-9-7-6-8-10-14/h6-10,12,19H,5,11H2,1-4H3/b16-15-