(2-oxidanylidene-2-phenylazanyl-ethyl) (E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) (E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: (2-anilino-2-oxo-ethyl) (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)-2-propenoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)acrylic acid (2-anilino-2-keto-ethyl) ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(=O)NC2=CC=CC=C2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=C/C(=O)OCC(=O)NC2=CC=CC=C2)OC

InChI

InChI=1S/C21H22ClNO5/c1-3-11-27-21-17(22)12-15(13-18(21)26-2)9-10-20(25)28-14-19(24)23-16-7-5-4-6-8-16/h4-10,12-13H,3,11,14H2,1-2H3,(H,23,24)/b10-9+