3-nitro-N-[3-(pentanoylamino)phenyl]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[3-(pentanoylamino)phenyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-nitro-N-[3-(pentanoylamino)phenyl]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-nitro-N-[3-(1-oxopentylamino)phenyl]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-nitro-N-[3-(pentanoylamino)phenyl]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-nitro-4-pyrrolidino-N-[3-(valerylamino)phenyl]benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

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