N-[3-(2-methylpropanoylamino)phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[3-(2-methylpropanoylamino)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[3-(2-methylpropanoylamino)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[3-(2-methylpropanoylamino)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[3-(isobutyrylamino)phenyl]-3-nitro-4-piperidino-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-15(2)21(27)23-17-7-6-8-18(14-17)24-22(28)16-9-10-19(20(13-16)26(29)30)25-11-4-3-5-12-25/h6-10,13-15H,3-5,11-12H2,1-2H3,(H,23,27)(H,24,28)