(1S,6S)-3,4-dimethyl-6-[[(2R)-4-phenylbutan-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-3,4-dimethyl-6-[[(2R)-4-phenylbutan-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-3,4-dimethyl-6-[[(1R)-1-methyl-3-phenyl-propyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-3,4-dimethyl-6-[oxo-[[(2R)-4-phenylbutan-2-yl]amino]methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-3,4-dimethyl-6-[[(2R)-4-phenylbutan-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-3,4-dimethyl-6-[[(1R)-1-methyl-3-phenyl-propyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C20H26NO3- MolecularWeight: 328.42534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC(C)CCC2=CC=CC=C2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@@H]([C@H](C1)C(=O)N[C@H](C)CCC2=CC=CC=C2)C(=O)[O-])C

InChI

InChI=1S/C20H27NO3/c1-13-11-17(18(20(23)24)12-14(13)2)19(22)21-15(3)9-10-16-7-5-4-6-8-16/h4-8,15,17-18H,9-12H2,1-3H3,(H,21,22)(H,23,24)/p-1/t15-,17+,18+/m1/s1