[2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 3-[(2-methylphenyl)carbonylamino]propanoate

Systemtic Name: [2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 3-[(2-methylphenyl)carbonylamino]propanoate Openeye Name: [2-methoxy-4-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenyl] 3-[(2-methylbenzoyl)amino]propanoate CAS Name: 3-[[(2-methylphenyl)-oxomethyl]amino]propanoic acid [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] 3-[(2-methylbenzoyl)amino]propanoate Traditional Name: 3-(o-toluoylamino)propionic acid [4-[(E)-3-keto-3-methoxy-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)OC2=C(C=C(C=C2)C=CC(=O)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)OC2=C(C=C(C=C2)/C=C/C(=O)OC)OC

InChI

InChI=1S/C22H23NO6/c1-15-6-4-5-7-17(15)22(26)23-13-12-21(25)29-18-10-8-16(14-19(18)27-2)9-11-20(24)28-3/h4-11,14H,12-13H2,1-3H3,(H,23,26)/b11-9+