8-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-5-nitro-quinoline

Systemtic Name: 8-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-5-nitro-quinoline Openeye Name: 8-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-5-nitro-quinoline CAS Name: 8-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-5-nitroquinoline IUPAC Name: 8-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-5-nitroquinoline Traditional Name: 8-[4-(3-fluoro-4-methoxy-benzyl)piperazino]-5-nitro-quinoline Formula: C21H21FN4O3 MolecularWeight: 396.414843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4)F

InChI

InChI=1S/C21H21FN4O3/c1-29-20-7-4-15(13-17(20)22)14-24-9-11-25(12-10-24)19-6-5-18(26(27)28)16-3-2-8-23-21(16)19/h2-8,13H,9-12,14H2,1H3