4-[(3-chlorophenyl)methyl-prop-2-enyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3-chlorophenyl)methyl-prop-2-enyl-amino]-4-oxidanylidene-butanoate Openeye Name: 4-[allyl-[(3-chlorophenyl)methyl]amino]-4-oxo-butanoate CAS Name: 4-[(3-chlorophenyl)methyl-prop-2-enylamino]-4-oxobutanoate IUPAC Name: 4-[(3-chlorophenyl)methyl-prop-2-enylamino]-4-oxobutanoate Traditional Name: 4-[allyl-(3-chlorobenzyl)amino]-4-keto-butyrate Formula: C14H15ClNO3- MolecularWeight: 280.7268

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC(=CC=C1)Cl)C(=O)CCC(=O)[O-]

Isomeric SMILES

C=CCN(CC1=CC(=CC=C1)Cl)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C14H16ClNO3/c1-2-8-16(13(17)6-7-14(18)19)10-11-4-3-5-12(15)9-11/h2-5,9H,1,6-8,10H2,(H,18,19)/p-1