ethyl 4-[[(E)-3-(4-acetyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[[(E)-3-(4-acetyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[[(E)-3-(4-acetoxy-3-methoxy-phenyl)prop-2-enoyl]amino]cyclohexanecarboxylate CAS Name: 4-[[(E)-3-(4-acetyloxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(4-acetyloxy-3-methoxyphenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[(E)-3-(4-acetoxy-3-methoxy-phenyl)acryloyl]amino]cyclohexanecarboxylic acid ethyl ester Formula: C21H27NO6 MolecularWeight: 389.44218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)NC(=O)C=CC2=CC(=C(C=C2)OC(=O)C)OC

Isomeric SMILES

CCOC(=O)C1CCC(CC1)NC(=O)/C=C/C2=CC(=C(C=C2)OC(=O)C)OC

InChI

InChI=1S/C21H27NO6/c1-4-27-21(25)16-7-9-17(10-8-16)22-20(24)12-6-15-5-11-18(28-14(2)23)19(13-15)26-3/h5-6,11-13,16-17H,4,7-10H2,1-3H3,(H,22,24)/b12-6+