3-(2-fluorophenyl)-2-[(4-methylpiperidin-1-yl)methyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-(2-fluorophenyl)-2-[(4-methylpiperidin-1-yl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-(2-fluorophenyl)-2-[(4-methyl-1-piperidyl)methyl]-6-nitro-quinazolin-4-one CAS Name: 3-(2-fluorophenyl)-2-[(4-methyl-1-piperidinyl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-(2-fluorophenyl)-2-[(4-methylpiperidin-1-yl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(2-fluorophenyl)-2-[(4-methylpiperidino)methyl]-6-nitro-quinazolin-4-one Formula: C21H21FN4O3 MolecularWeight: 396.414843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4F

Isomeric SMILES

CC1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4F

InChI

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