ethyl (E,4S)-4-cyclohexyl-2-methyl-4-(phenylmethoxycarbonylamino)but-2-enoate

Systemtic Name: ethyl (E,4S)-4-cyclohexyl-2-methyl-4-(phenylmethoxycarbonylamino)but-2-enoate Openeye Name: ethyl (E,4S)-4-(benzyloxycarbonylamino)-4-cyclohexyl-2-methyl-but-2-enoate CAS Name: (E,4S)-4-cyclohexyl-2-methyl-4-(phenylmethoxycarbonylamino)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-cyclohexyl-2-methyl-4-(phenylmethoxycarbonylamino)but-2-enoate Traditional Name: (E,4S)-4-(benzyloxycarbonylamino)-4-cyclohexyl-2-methyl-but-2-enoic acid ethyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(C1CCCCC1)NC(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)/C(=C/[C@H](C1CCCCC1)NC(=O)OCC2=CC=CC=C2)/C

InChI

InChI=1S/C21H29NO4/c1-3-25-20(23)16(2)14-19(18-12-8-5-9-13-18)22-21(24)26-15-17-10-6-4-7-11-17/h4,6-7,10-11,14,18-19H,3,5,8-9,12-13,15H2,1-2H3,(H,22,24)/b16-14+/t19-/m1/s1