(4-methoxyphenyl)methyl 4-[4-[(4-nitrophenyl)methoxycarbonylamino]butanoyl]piperazine-1-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 4-[4-[(4-nitrophenyl)methoxycarbonylamino]butanoyl]piperazine-1-carboxylate Openeye Name: (4-methoxyphenyl)methyl 4-[4-[(4-nitrophenyl)methoxycarbonylamino]butanoyl]piperazine-1-carboxylate CAS Name: 4-[4-[[(4-nitrophenyl)methoxy-oxomethyl]amino]-1-oxobutyl]-1-piperazinecarboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 4-[4-[(4-nitrophenyl)methoxycarbonylamino]butanoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(4-nitrobenzyl)oxycarbonylamino]butanoyl]piperazine-1-carboxylic acid p-anisyl ester Formula: C25H30N4O8 MolecularWeight: 514.5277

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)N2CCN(CC2)C(=O)CCCNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)N2CCN(CC2)C(=O)CCCNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O8/c1-35-22-10-6-20(7-11-22)18-37-25(32)28-15-13-27(14-16-28)23(30)3-2-12-26-24(31)36-17-19-4-8-21(9-5-19)29(33)34/h4-11H,2-3,12-18H2,1H3,(H,26,31)