4-[2-[methyl-[(2-nitrophenyl)methyl]amino]ethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[methyl-[(2-nitrophenyl)methyl]amino]ethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-[methyl-[(2-nitrophenyl)methyl]amino]acetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[methyl-[(2-nitrophenyl)methyl]amino]-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[methyl-[(2-nitrophenyl)methyl]amino]acetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[methyl-(2-nitrobenzyl)amino]acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C21H25N5O4 MolecularWeight: 411.4543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])CC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])CC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25N5O4/c1-23(15-17-7-5-6-10-19(17)26(29)30)16-20(27)24-11-13-25(14-12-24)21(28)22-18-8-3-2-4-9-18/h2-10H,11-16H2,1H3,(H,22,28)