(1R,2S)-2-[(4-benzamido-2,5-diethoxy-phenyl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[(4-benzamido-2,5-diethoxy-phenyl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[(4-benzamido-2,5-diethoxy-phenyl)carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[(4-benzamido-2,5-diethoxyanilino)-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[(4-benzamido-2,5-diethoxyphenyl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[(4-benzamido-2,5-diethoxy-phenyl)carbamoyl]cyclohexanecarboxylate Formula: C25H29N2O6- MolecularWeight: 453.50756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)C3CCCCC3C(=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)[C@H]3CCCC[C@H]3C(=O)[O-]

InChI

InChI=1S/C25H30N2O6/c1-3-32-21-15-20(27-24(29)17-12-8-9-13-18(17)25(30)31)22(33-4-2)14-19(21)26-23(28)16-10-6-5-7-11-16/h5-7,10-11,14-15,17-18H,3-4,8-9,12-13H2,1-2H3,(H,26,28)(H,27,29)(H,30,31)/p-1/t17-,18+/m0/s1