4-[ethyl-(phenylmethyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[ethyl-(phenylmethyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[benzyl(ethyl)amino]-4-oxo-but-2-enoic acid CAS Name: 4-[ethyl-(phenylmethyl)amino]-4-oxo-2-butenoic acid IUPAC Name: 4-[benzyl(ethyl)amino]-4-oxobut-2-enoic acid Traditional Name: 4-[benzyl(ethyl)amino]-4-keto-but-2-enoic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C=CC(=O)O

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C=CC(=O)O

InChI

InChI=1S/C13H15NO3/c1-2-14(12(15)8-9-13(16)17)10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,16,17)