2-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]-N-phenethyl-benzamide

Systemtic Name: 2-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]-N-phenethyl-benzamide Openeye Name: 2-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]-N-phenethyl-benzamide CAS Name: 2-[[(E)-3-[4-[(cyclopropylamino)-oxomethyl]phenyl]-1-oxoprop-2-enyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]-N-phenethylbenzamide Traditional Name: 2-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]acryloyl]amino]-N-phenethyl-benzamide Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)C=CC(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)/C=C/C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O3/c32-26(17-12-21-10-13-22(14-11-21)27(33)30-23-15-16-23)31-25-9-5-4-8-24(25)28(34)29-19-18-20-6-2-1-3-7-20/h1-14,17,23H,15-16,18-19H2,(H,29,34)(H,30,33)(H,31,32)/b17-12+