(5-methyl-2-oxidanyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (5-methyl-2-oxidanyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (2-hydroxy-5-methyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (2-hydroxy-5-methylphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (2-hydroxy-5-methylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (2-hydroxy-5-methyl-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C18H19N3O4 MolecularWeight: 341.36116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4/c1-13-2-7-17(22)16(12-13)18(23)20-10-8-19(9-11-20)14-3-5-15(6-4-14)21(24)25/h2-7,12,22H,8-11H2,1H3