2-(4-methylcyclohex-3-en-1-yl)propan-2-yl 3-benzamido-2-oxidanyl-3-phenyl-propanoate

Systemtic Name: 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl 3-benzamido-2-oxidanyl-3-phenyl-propanoate Openeye Name: [1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl] 3-benzamido-2-hydroxy-3-phenyl-propanoate CAS Name: 3-benzamido-2-hydroxy-3-phenylpropanoic acid 2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl ester IUPAC Name: 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl 3-benzamido-2-hydroxy-3-phenylpropanoate Traditional Name: 3-benzamido-2-hydroxy-3-phenyl-propionic acid [1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl] ester Formula: C26H31NO4 MolecularWeight: 421.52864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)C(C)(C)OC(=O)C(C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CCC(CC1)C(C)(C)OC(=O)C(C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C26H31NO4/c1-18-14-16-21(17-15-18)26(2,3)31-25(30)23(28)22(19-10-6-4-7-11-19)27-24(29)20-12-8-5-9-13-20/h4-14,21-23,28H,15-17H2,1-3H3,(H,27,29)