2-[[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-phenyl-amino]ethanoic acid

Systemtic Name: 2-[[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-phenyl-amino]ethanoic acid Openeye Name: 2-(N-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]anilino)acetic acid CAS Name: 2-(N-[2-[4-(4-nitrophenyl)-1-piperazinyl]-2-oxoethyl]anilino)acetic acid IUPAC Name: 2-(N-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl]anilino)acetic acid Traditional Name: 2-(N-[2-keto-2-[4-(4-nitrophenyl)piperazino]ethyl]anilino)acetic acid Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CN(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CN(CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O5/c25-19(14-23(15-20(26)27)16-4-2-1-3-5-16)22-12-10-21(11-13-22)17-6-8-18(9-7-17)24(28)29/h1-9H,10-15H2,(H,26,27)