[2-[(4-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-phenylmethoxyphenyl)prop-2-enoate

Systemtic Name: [2-[(4-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-phenylmethoxyphenyl)prop-2-enoate Openeye Name: [2-(4-chloro-2-methyl-anilino)-2-oxo-ethyl] (E)-3-(4-benzyloxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-phenylmethoxyphenyl)-2-propenoic acid [2-(4-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-2-methylanilino)-2-oxoethyl] (E)-3-(4-phenylmethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-benzoxyphenyl)acrylic acid [2-(4-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C25H22ClNO4 MolecularWeight: 435.89948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)COC(=O)C=CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)COC(=O)/C=C/C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H22ClNO4/c1-18-15-21(26)10-13-23(18)27-24(28)17-31-25(29)14-9-19-7-11-22(12-8-19)30-16-20-5-3-2-4-6-20/h2-15H,16-17H2,1H3,(H,27,28)/b14-9+