4-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-phenyl-quinazoline

Systemtic Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-phenyl-quinazoline Openeye Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-phenyl-quinazoline CAS Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-phenylquinazoline IUPAC Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-phenylquinazoline Traditional Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-phenyl-quinazoline Formula: C20H23N4+ MolecularWeight: 319.42342

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4/c1-23-12-7-13-24(15-14-23)20-17-10-5-6-11-18(17)21-19(22-20)16-8-3-2-4-9-16/h2-6,8-11H,7,12-15H2,1H3/p+1