bis[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-(3-methoxypropyl)azanium

Systemtic Name: bis[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-(3-methoxypropyl)azanium Openeye Name: bis[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-(3-methoxypropyl)ammonium CAS Name: bis[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-(3-methoxypropyl)ammonium IUPAC Name: bis[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-(3-methoxypropyl)azanium Traditional Name: bis[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-(3-methoxypropyl)ammonium Formula: C22H22Cl2N5O3+ MolecularWeight: 475.34778

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH+](CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

COCCC[NH+](CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C22H21Cl2N5O3/c1-32-8-2-7-29(11-19-25-17-9-13(23)3-5-15(17)21(30)27-19)12-20-26-18-10-14(24)4-6-16(18)22(31)28-20/h3-6,9-10H,2,7-8,11-12H2,1H3,(H,25,27,30)(H,26,28,31)/p+1