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

Systemtic Name: 3-(3-methoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-(3-methoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-quinazolin-4-one CAS Name: 3-(3-methoxyphenyl)-2-[(4-methyl-1-piperazinyl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-(3-methoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(3-methoxyphenyl)-2-[(4-methylpiperazino)methyl]-6-nitro-quinazolin-4-one Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC(=CC=C4)OC

Isomeric SMILES

CN1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC(=CC=C4)OC

InChI

InChI=1S/C21H23N5O4/c1-23-8-10-24(11-9-23)14-20-22-19-7-6-16(26(28)29)13-18(19)21(27)25(20)15-4-3-5-17(12-15)30-2/h3-7,12-13H,8-11,14H2,1-2H3