7-[3-[methyl-(phenylmethyl)amino]propylamino]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[3-[methyl-(phenylmethyl)amino]propylamino]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[3-[benzyl(methyl)amino]propylamino]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[3-[methyl-(phenylmethyl)amino]propylamino]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[3-[benzyl(methyl)amino]propylamino]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[3-[benzyl(methyl)amino]propylamino]-6-nitro-1H-quinazolin-4-one Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC1=C(C=C2C(=C1)NC=NC2=O)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC1=C(C=C2C(=C1)NC=NC2=O)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H21N5O3/c1-23(12-14-6-3-2-4-7-14)9-5-8-20-17-11-16-15(10-18(17)24(26)27)19(25)22-13-21-16/h2-4,6-7,10-11,13,20H,5,8-9,12H2,1H3,(H,21,22,25)