(4-nitrophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (4-nitrophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Openeye Name: (4-nitrophenyl)-[4-(4-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (4-nitrophenyl)-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-nitrophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Traditional Name: (4-nitrophenyl)-[4-(4-pyridylmethyl)piperazino]methanone Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O3/c22-17(15-1-3-16(4-2-15)21(23)24)20-11-9-19(10-12-20)13-14-5-7-18-8-6-14/h1-8H,9-13H2