[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]-(2-nitrophenyl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-yl)piperazin-1-yl]-(2-nitrophenyl)methanone Openeye Name: [4-(1,3-benzodioxol-5-yl)piperazin-1-yl]-(2-nitrophenyl)methanone CAS Name: [4-(1,3-benzodioxol-5-yl)-1-piperazinyl]-(2-nitrophenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-yl)piperazin-1-yl]-(2-nitrophenyl)methanone Traditional Name: [4-(1,3-benzodioxol-5-yl)piperazino]-(2-nitrophenyl)methanone Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5/c22-18(14-3-1-2-4-15(14)21(23)24)20-9-7-19(8-10-20)13-5-6-16-17(11-13)26-12-25-16/h1-6,11H,7-10,12H2