N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-3-nitro-4-piperidino-benzamide Formula: C26H24N4O6 MolecularWeight: 488.49196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5)[N+](=O)[O-]

InChI

InChI=1S/C26H24N4O6/c31-25(17-8-10-21(22(14-17)30(33)34)29-12-4-1-5-13-29)28-20-7-3-2-6-19(20)26(32)27-18-9-11-23-24(15-18)36-16-35-23/h2-3,6-11,14-15H,1,4-5,12-13,16H2,(H,27,32)(H,28,31)