(1S,6R)-6-[[2-(phenylmethyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-[[2-(phenylmethyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[(2-benzylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[oxo-[2-(phenylmethyl)anilino]methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[(2-benzylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[(2-benzylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C21H20NO3- MolecularWeight: 334.3884

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC=CC=C2CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1C=CC[C@@H]([C@@H]1C(=O)NC2=CC=CC=C2CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C21H21NO3/c23-20(17-11-5-6-12-18(17)21(24)25)22-19-13-7-4-10-16(19)14-15-8-2-1-3-9-15/h1-10,13,17-18H,11-12,14H2,(H,22,23)(H,24,25)/p-1/t17-,18+/m1/s1