4-(4-nitrophenyl)carbonyl-1-(phenylmethyl)piperazin-2-one

Systemtic Name: 4-(4-nitrophenyl)carbonyl-1-(phenylmethyl)piperazin-2-one Openeye Name: 1-benzyl-4-(4-nitrobenzoyl)piperazin-2-one CAS Name: 4-[(4-nitrophenyl)-oxomethyl]-1-(phenylmethyl)-2-piperazinone IUPAC Name: 1-benzyl-4-(4-nitrobenzoyl)piperazin-2-one Traditional Name: 1-benzyl-4-(4-nitrobenzoyl)piperazin-2-one Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)CN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O4/c22-17-13-20(11-10-19(17)12-14-4-2-1-3-5-14)18(23)15-6-8-16(9-7-15)21(24)25/h1-9H,10-13H2