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

Systemtic Name: 3-(3-methoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-(3-methoxyphenyl)-2-[(4-methyl-1-piperidyl)methyl]-6-nitro-quinazolin-4-one CAS Name: 3-(3-methoxyphenyl)-2-[(4-methyl-1-piperidinyl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-(3-methoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(3-methoxyphenyl)-2-[(4-methylpiperidino)methyl]-6-nitro-quinazolin-4-one Formula: C22H24N4O4 MolecularWeight: 408.45036

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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=C4)OC

Isomeric SMILES

CC1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC(=CC=C4)OC

InChI

InChI=1S/C22H24N4O4/c1-15-8-10-24(11-9-15)14-21-23-20-7-6-17(26(28)29)13-19(20)22(27)25(21)16-4-3-5-18(12-16)30-2/h3-7,12-13,15H,8-11,14H2,1-2H3