(1R,2R)-2-[[4-(3-methylphenoxy)phenyl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2R)-2-[[4-(3-methylphenoxy)phenyl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-[[4-(3-methylphenoxy)phenyl]carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[[4-(3-methylphenoxy)anilino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-[[4-(3-methylphenoxy)phenyl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[[4-(3-methylphenoxy)phenyl]carbamoyl]cyclohexanecarboxylate Formula: C21H22NO4- MolecularWeight: 352.40368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)C3CCCCC3C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)[C@@H]3CCCC[C@H]3C(=O)[O-]

InChI

InChI=1S/C21H23NO4/c1-14-5-4-6-17(13-14)26-16-11-9-15(10-12-16)22-20(23)18-7-2-3-8-19(18)21(24)25/h4-6,9-13,18-19H,2-3,7-8H2,1H3,(H,22,23)(H,24,25)/p-1/t18-,19-/m1/s1