4-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]-1-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]-1-methyl-cyclohexane-1-carboxylic acid Openeye Name: 4-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]amino]-1-methyl-cyclohexanecarboxylic acid CAS Name: 4-[[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]-1-methylcyclohexane-1-carboxylic acid Traditional Name: 4-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]amino]-1-methyl-cyclohexanecarboxylic acid Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)NC(=O)C=CC2=CC(=C(C=C2)O)OC)C(=O)O

Isomeric SMILES

CC1(CCC(CC1)NC(=O)/C=C/C2=CC(=C(C=C2)O)OC)C(=O)O

InChI

InChI=1S/C18H23NO5/c1-18(17(22)23)9-7-13(8-10-18)19-16(21)6-4-12-3-5-14(20)15(11-12)24-2/h3-6,11,13,20H,7-10H2,1-2H3,(H,19,21)(H,22,23)/b6-4+