2-[[(Z)-2-acetamido-3-(2-methylphenyl)prop-2-enoyl]amino]-N-phenethyl-benzamide

Systemtic Name: 2-[[(Z)-2-acetamido-3-(2-methylphenyl)prop-2-enoyl]amino]-N-phenethyl-benzamide Openeye Name: 2-[[(Z)-2-acetamido-3-(o-tolyl)prop-2-enoyl]amino]-N-phenethyl-benzamide CAS Name: 2-[[(Z)-2-acetamido-3-(2-methylphenyl)-1-oxoprop-2-enyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[(Z)-2-acetamido-3-(2-methylphenyl)prop-2-enoyl]amino]-N-phenethylbenzamide Traditional Name: 2-[[(Z)-2-acetamido-3-(o-tolyl)acryloyl]amino]-N-phenethyl-benzamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1/C=C(/C(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)\NC(=O)C

InChI

InChI=1S/C27H27N3O3/c1-19-10-6-7-13-22(19)18-25(29-20(2)31)27(33)30-24-15-9-8-14-23(24)26(32)28-17-16-21-11-4-3-5-12-21/h3-15,18H,16-17H2,1-2H3,(H,28,32)(H,29,31)(H,30,33)/b25-18-