(4-azanyl-3-nitro-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (4-azanyl-3-nitro-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: (4-amino-3-nitro-phenyl)-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (4-amino-3-nitrophenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-amino-3-nitrophenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (4-amino-3-nitro-phenyl)-[4-(3-fluoro-4-methoxy-benzyl)piperazino]methanone Formula: C19H21FN4O4 MolecularWeight: 388.392843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])F

InChI

InChI=1S/C19H21FN4O4/c1-28-18-5-2-13(10-15(18)20)12-22-6-8-23(9-7-22)19(25)14-3-4-16(21)17(11-14)24(26)27/h2-5,10-11H,6-9,12,21H2,1H3