7-chloranyl-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]azaniumyl]methyl]quinazolin-4-olate

Systemtic Name: 7-chloranyl-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]azaniumyl]methyl]quinazolin-4-olate Openeye Name: 7-chloro-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]ammonio]methyl]quinazolin-4-olate CAS Name: 7-chloro-2-[[methyl-[[2-(1-pyrrolidinyl)phenyl]methyl]ammonio]methyl]-4-quinazolinolate IUPAC Name: 7-chloro-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]azaniumyl]methyl]quinazolin-4-olate Traditional Name: 7-chloro-2-[[methyl-(2-pyrrolidinobenzyl)ammonio]methyl]quinazolin-4-olate Formula: C21H23ClN4O MolecularWeight: 382.88652

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1N2CCCC2)CC3=NC4=C(C=CC(=C4)Cl)C(=N3)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1N2CCCC2)CC3=NC4=C(C=CC(=C4)Cl)C(=N3)[O-]

InChI

InChI=1S/C21H23ClN4O/c1-25(13-15-6-2-3-7-19(15)26-10-4-5-11-26)14-20-23-18-12-16(22)8-9-17(18)21(27)24-20/h2-3,6-9,12H,4-5,10-11,13-14H2,1H3,(H,23,24,27)