4-[(E)-3-[(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethyl)amino]-2-methyl-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-[(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethyl)amino]-2-methyl-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-[benzyl-(2-ethoxy-2-oxo-ethyl)amino]-2-methyl-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-[(2-ethoxy-2-oxoethyl)-(phenylmethyl)amino]-2-methyl-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-[benzyl-(2-ethoxy-2-oxoethyl)amino]-2-methyl-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-[benzyl-(2-ethoxy-2-keto-ethyl)amino]-3-keto-2-methyl-prop-1-enyl]benzoic acid Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CC=C1)C(=O)C(=CC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CC=C1)C(=O)/C(=C/C2=CC=C(C=C2)C(=O)O)/C

InChI

InChI=1S/C22H23NO5/c1-3-28-20(24)15-23(14-18-7-5-4-6-8-18)21(25)16(2)13-17-9-11-19(12-10-17)22(26)27/h4-13H,3,14-15H2,1-2H3,(H,26,27)/b16-13+