methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(phenylmethyl)amino]but-2-enoate

Systemtic Name: methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(phenylmethyl)amino]but-2-enoate Openeye Name: methyl (E)-3-(benzylamino)-2-(tert-butoxycarbonylamino)but-2-enoate CAS Name: (E)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(phenylmethyl)amino]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-(benzylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]but-2-enoate Traditional Name: (E)-3-(benzylamino)-2-(tert-butoxycarbonylamino)but-2-enoic acid methyl ester Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)NC(=O)OC(C)(C)C)NCC1=CC=CC=C1

Isomeric SMILES

C/C(=C(/C(=O)OC)\NC(=O)OC(C)(C)C)/NCC1=CC=CC=C1

InChI

InChI=1S/C17H24N2O4/c1-12(18-11-13-9-7-6-8-10-13)14(15(20)22-5)19-16(21)23-17(2,3)4/h6-10,18H,11H2,1-5H3,(H,19,21)/b14-12+