(5-methyl-2-propan-2-yl-cyclohexyl) (2S)-2-(2-methylprop-2-enoylamino)-3-phenyl-propanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) (2S)-2-(2-methylprop-2-enoylamino)-3-phenyl-propanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) (2S)-2-(2-methylprop-2-enoylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[(2-methyl-1-oxoprop-2-enyl)amino]-3-phenylpropanoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) (2S)-2-(2-methylprop-2-enoylamino)-3-phenylpropanoate Traditional Name: (2S)-2-methacrylamido-3-phenyl-propionic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C23H33NO3 MolecularWeight: 371.51302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(CC2=CC=CC=C2)NC(=O)C(=C)C)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C(=C)C)C(C)C

InChI

InChI=1S/C23H33NO3/c1-15(2)19-12-11-17(5)13-21(19)27-23(26)20(24-22(25)16(3)4)14-18-9-7-6-8-10-18/h6-10,15,17,19-21H,3,11-14H2,1-2,4-5H3,(H,24,25)/t17?,19?,20-,21?/m0/s1