N-cyclohexylcyclohexanamine; (E,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-4-enoic acid

Systemtic Name: N-cyclohexylcyclohexanamine; (E,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-4-enoic acid Openeye Name: (E,2R)-2-(tert-butoxycarbonylamino)-5-phenyl-pent-4-enoic acid; N-cyclohexylcyclohexanamine CAS Name: N-cyclohexylcyclohexanamine; (E,2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenyl-4-pentenoic acid IUPAC Name: N-cyclohexylcyclohexanamine; (E,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpent-4-enoic acid Traditional Name: (E,2R)-2-(tert-butoxycarbonylamino)-5-phenyl-pent-4-enoic acid; dicyclohexylamine Formula: C28H44N2O4 MolecularWeight: 472.65996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC=CC1=CC=CC=C1)C(=O)O.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](C/C=C/C1=CC=CC=C1)C(=O)O.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C16H21NO4.C12H23N/c1-16(2,3)21-15(20)17-13(14(18)19)11-7-10-12-8-5-4-6-9-12;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-10,13H,11H2,1-3H3,(H,17,20)(H,18,19);11-13H,1-10H2/b10-7+;/t13-;/m1./s1