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

Systemtic Name: (2-chloranyl-7-methyl-quinolin-3-yl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (2-chloro-7-methyl-3-quinolyl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (2-chloro-7-methyl-3-quinolinyl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (2-chloro-7-methylquinolin-3-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (2-chloro-7-methyl-3-quinolyl)methyl-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C21H20ClN4O+ MolecularWeight: 379.8627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C[NH+](C)CC3=NC(=O)C4=CC=CC=C4N3)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C[NH+](C)CC3=NC(=O)C4=CC=CC=C4N3)Cl

InChI

InChI=1S/C21H19ClN4O/c1-13-7-8-14-10-15(20(22)24-18(14)9-13)11-26(2)12-19-23-17-6-4-3-5-16(17)21(27)25-19/h3-10H,11-12H2,1-2H3,(H,23,25,27)/p+1