3-methylbutyl 4-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: 3-methylbutyl 4-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate Openeye Name: isopentyl 4-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]amino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(2,4-dichlorophenyl)acryloyl]amino]benzoic acid isoamyl ester Formula: C21H21Cl2NO3 MolecularWeight: 406.30234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C21H21Cl2NO3/c1-14(2)11-12-27-21(26)16-4-8-18(9-5-16)24-20(25)10-6-15-3-7-17(22)13-19(15)23/h3-10,13-14H,11-12H2,1-2H3,(H,24,25)/b10-6+