[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] pentanoate

Systemtic Name: [2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] pentanoate Openeye Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxo-ethyl] pentanoate CAS Name: pentanoic acid [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] pentanoate Traditional Name: valeric acid [2-keto-2-[2-(4-nitroanilino)ethylamino]ethyl] ester Formula: C15H21N3O5 MolecularWeight: 323.34434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC(=O)NCCNC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)OCC(=O)NCCNC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O5/c1-2-3-4-15(20)23-11-14(19)17-10-9-16-12-5-7-13(8-6-12)18(21)22/h5-8,16H,2-4,9-11H2,1H3,(H,17,19)