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

Systemtic Name: 4-[(E)-3-[(4-ethoxy-4-oxidanylidene-butyl)-prop-2-enyl-amino]-2-methyl-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-[allyl-(4-ethoxy-4-oxo-butyl)amino]-2-methyl-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-[(4-ethoxy-4-oxobutyl)-prop-2-enylamino]-2-methyl-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-[(4-ethoxy-4-oxobutyl)-prop-2-enylamino]-2-methyl-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-[allyl-(4-ethoxy-4-keto-butyl)amino]-3-keto-2-methyl-prop-1-enyl]benzoic acid Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(CC=C)C(=O)C(=CC1=CC=C(C=C1)C(=O)O)C

Isomeric SMILES

CCOC(=O)CCCN(CC=C)C(=O)/C(=C/C1=CC=C(C=C1)C(=O)O)/C

InChI

InChI=1S/C20H25NO5/c1-4-12-21(13-6-7-18(22)26-5-2)19(23)15(3)14-16-8-10-17(11-9-16)20(24)25/h4,8-11,14H,1,5-7,12-13H2,2-3H3,(H,24,25)/b15-14+