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

Systemtic Name: N-[3-methoxy-4-(pentanoylamino)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[3-methoxy-4-(pentanoylamino)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[3-methoxy-4-(1-oxopentylamino)phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[3-methoxy-4-(pentanoylamino)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[3-methoxy-4-(valerylamino)phenyl]-3-nitro-4-piperidino-benzamide Formula: C24H30N4O5 MolecularWeight: 454.5188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O5/c1-3-4-8-23(29)26-19-11-10-18(16-22(19)33-2)25-24(30)17-9-12-20(21(15-17)28(31)32)27-13-6-5-7-14-27/h9-12,15-16H,3-8,13-14H2,1-2H3,(H,25,30)(H,26,29)