N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-[4-(4-nitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(4-nitrophenyl)piperazino]acetamide Formula: C20H21N5O6 MolecularWeight: 427.41064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O6/c26-19(22-20(27)21-14-1-6-17-18(11-14)31-13-30-17)12-23-7-9-24(10-8-23)15-2-4-16(5-3-15)25(28)29/h1-6,11H,7-10,12-13H2,(H2,21,22,26,27)