methyl 1-[[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-enoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-1-oxoprop-2-enyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)acryloyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H28ClNO5 MolecularWeight: 409.90372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=CC(=O)NC2(CCCCC2)C(=O)OC)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C/C(=O)NC2(CCCCC2)C(=O)OC)OC

InChI

InChI=1S/C21H28ClNO5/c1-14(2)28-19-16(22)12-15(13-17(19)26-3)8-9-18(24)23-21(20(25)27-4)10-6-5-7-11-21/h8-9,12-14H,5-7,10-11H2,1-4H3,(H,23,24)/b9-8+