methyl 1-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[(E)-3-[4-[(cyclopropylamino)-oxomethyl]phenyl]-1-oxoprop-2-enyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]acryloyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C=CC2=CC=C(C=C2)C(=O)NC3CC3

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)/C=C/C2=CC=C(C=C2)C(=O)NC3CC3

InChI

InChI=1S/C21H26N2O4/c1-27-20(26)21(13-3-2-4-14-21)23-18(24)12-7-15-5-8-16(9-6-15)19(25)22-17-10-11-17/h5-9,12,17H,2-4,10-11,13-14H2,1H3,(H,22,25)(H,23,24)/b12-7+