[4-(2-hydroxyphenyl)piperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone

Systemtic Name: [4-(2-hydroxyphenyl)piperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone Openeye Name: [4-(2-hydroxyphenyl)piperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone CAS Name: [4-(2-hydroxyphenyl)-1-piperazinyl]-(3-methyl-4-nitrophenyl)methanone IUPAC Name: [4-(2-hydroxyphenyl)piperazin-1-yl]-(3-methyl-4-nitrophenyl)methanone Traditional Name: [4-(2-hydroxyphenyl)piperazino]-(3-methyl-4-nitro-phenyl)methanone Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3O)[N+](=O)[O-]

InChI

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