2-[[(E)-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-but-2-en-2-yl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(E)-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-but-2-en-2-yl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(E)-3-[(2-ethoxy-2-oxo-ethyl)amino]-1-methyl-3-oxo-prop-1-enyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(E)-4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobut-2-en-2-yl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(E)-4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobut-2-en-2-yl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(E)-3-[(2-ethoxy-2-keto-ethyl)amino]-3-keto-1-methyl-prop-1-enyl]amino]-3-phenyl-propionic acid Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C=C(C)NC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCOC(=O)CNC(=O)/C=C(\C)/NC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C17H22N2O5/c1-3-24-16(21)11-18-15(20)9-12(2)19-14(17(22)23)10-13-7-5-4-6-8-13/h4-9,14,19H,3,10-11H2,1-2H3,(H,18,20)(H,22,23)/b12-9+