methyl 3-[2-[(E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoyl]oxyethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[(E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoyl]oxyethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[(E)-3-(3-chloro-4-methyl-phenyl)prop-2-enoyl]oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(E)-3-(3-chloro-4-methylphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[(E)-3-(3-chloro-4-methylphenyl)prop-2-enoyl]oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[(E)-3-(3-chloro-4-methyl-phenyl)acryloyl]oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H20ClNO5 MolecularWeight: 401.8402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClNO5/c1-13-4-6-15(10-17(13)22)7-9-20(25)28-12-19(24)23-18-11-16(21(26)27-3)8-5-14(18)2/h4-11H,12H2,1-3H3,(H,23,24)/b9-7+