(E)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylsulfanyl-pent-2-enoate

Systemtic Name: (E)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylsulfanyl-pent-2-enoate Openeye Name: (E)-4-(tert-butoxycarbonylamino)-5-phenylsulfanyl-pent-2-enoate CAS Name: (E)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(phenylthio)-2-pentenoate IUPAC Name: (E)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylsulfanylpent-2-enoate Traditional Name: (E)-4-(tert-butoxycarbonylamino)-5-(phenylthio)pent-2-enoate Formula: C16H20NO4S- MolecularWeight: 322.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSC1=CC=CC=C1)C=CC(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSC1=CC=CC=C1)/C=C/C(=O)[O-]

InChI

InChI=1S/C16H21NO4S/c1-16(2,3)21-15(20)17-12(9-10-14(18)19)11-22-13-7-5-4-6-8-13/h4-10,12H,11H2,1-3H3,(H,17,20)(H,18,19)/p-1/b10-9+