(phenylmethyl) 5-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-[(4-nitrophenyl)methylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 5-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-[(4-nitrophenyl)methylamino]-5-oxidanylidene-pentanoate Openeye Name: benzyl 5-[(2-ethoxy-2-oxo-ethyl)amino]-4-[(4-nitrophenyl)methylamino]-5-oxo-pentanoate CAS Name: 5-[(2-ethoxy-2-oxoethyl)amino]-4-[(4-nitrophenyl)methylamino]-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[(2-ethoxy-2-oxoethyl)amino]-4-[(4-nitrophenyl)methylamino]-5-oxopentanoate Traditional Name: 5-[(2-ethoxy-2-keto-ethyl)amino]-5-keto-4-[(4-nitrobenzyl)amino]valeric acid benzyl ester Formula: C23H27N3O7 MolecularWeight: 457.47638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O7/c1-2-32-22(28)15-25-23(29)20(24-14-17-8-10-19(11-9-17)26(30)31)12-13-21(27)33-16-18-6-4-3-5-7-18/h3-11,20,24H,2,12-16H2,1H3,(H,25,29)