7-[methyl-[2-(3-methylphenoxy)ethyl]amino]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[methyl-[2-(3-methylphenoxy)ethyl]amino]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[methyl-[2-(3-methylphenoxy)ethyl]amino]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[methyl-[2-(3-methylphenoxy)ethyl]amino]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[methyl-[2-(3-methylphenoxy)ethyl]amino]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[methyl-[2-(3-methylphenoxy)ethyl]amino]-6-nitro-1H-quinazolin-4-one Formula: C18H18N4O4 MolecularWeight: 354.35992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN(C)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCN(C)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4/c1-12-4-3-5-13(8-12)26-7-6-21(2)16-10-15-14(9-17(16)22(24)25)18(23)20-11-19-15/h3-5,8-11H,6-7H2,1-2H3,(H,19,20,23)