(1R,2S)-2-[[3-[(4-methoxyphenyl)carbamoyl]-4-piperidin-1-yl-phenyl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[[3-[(4-methoxyphenyl)carbamoyl]-4-piperidin-1-yl-phenyl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[[3-[(4-methoxyphenyl)carbamoyl]-4-(1-piperidyl)phenyl]carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[3-[(4-methoxyanilino)-oxomethyl]-4-(1-piperidinyl)anilino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[[3-[(4-methoxyphenyl)carbamoyl]-4-piperidin-1-ylphenyl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[[3-[(4-methoxyphenyl)carbamoyl]-4-piperidino-phenyl]carbamoyl]cyclohexanecarboxylate Formula: C27H32N3O5- MolecularWeight: 478.56008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C3CCCCC3C(=O)[O-])N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)[C@H]3CCCC[C@H]3C(=O)[O-])N4CCCCC4

InChI

InChI=1S/C27H33N3O5/c1-35-20-12-9-18(10-13-20)28-26(32)23-17-19(11-14-24(23)30-15-5-2-6-16-30)29-25(31)21-7-3-4-8-22(21)27(33)34/h9-14,17,21-22H,2-8,15-16H2,1H3,(H,28,32)(H,29,31)(H,33,34)/p-1/t21-,22+/m0/s1