(1R,2S)-2-[(4-ethoxy-3-methoxy-phenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[(4-ethoxy-3-methoxy-phenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[(4-ethoxy-3-methoxy-phenyl)methylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[(4-ethoxy-3-methoxyphenyl)methylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[(4-ethoxy-3-methoxyphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[(4-ethoxy-3-methoxy-benzyl)carbamoyl]cyclohexanecarboxylic acid Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2CCCCC2C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)[C@H]2CCCC[C@H]2C(=O)O)OC

InChI

InChI=1S/C18H25NO5/c1-3-24-15-9-8-12(10-16(15)23-2)11-19-17(20)13-6-4-5-7-14(13)18(21)22/h8-10,13-14H,3-7,11H2,1-2H3,(H,19,20)(H,21,22)/t13-,14+/m0/s1