(phenylmethyl) 5-[[4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 5-[[4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: benzyl 5-[4-[(E)-3-methoxy-3-oxo-prop-1-enyl]anilino]-5-oxo-pentanoate CAS Name: 5-[4-[(E)-3-methoxy-3-oxoprop-1-enyl]anilino]-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[4-[(E)-3-methoxy-3-oxoprop-1-enyl]anilino]-5-oxopentanoate Traditional Name: 5-keto-5-[4-[(E)-3-keto-3-methoxy-prop-1-enyl]anilino]valeric acid benzyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)NC(=O)CCCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)NC(=O)CCCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H23NO5/c1-27-21(25)15-12-17-10-13-19(14-11-17)23-20(24)8-5-9-22(26)28-16-18-6-3-2-4-7-18/h2-4,6-7,10-15H,5,8-9,16H2,1H3,(H,23,24)/b15-12+