3-azanyl-2-[3-(2,4-dimethoxyphenyl)propyl]-4aH-quinazolin-3-ium-4-one

Systemtic Name: 3-azanyl-2-[3-(2,4-dimethoxyphenyl)propyl]-4aH-quinazolin-3-ium-4-one Openeye Name: 3-amino-2-[3-(2,4-dimethoxyphenyl)propyl]-4aH-quinazolin-3-ium-4-one CAS Name: 3-amino-2-[3-(2,4-dimethoxyphenyl)propyl]-4aH-quinazolin-3-ium-4-one IUPAC Name: 3-amino-2-[3-(2,4-dimethoxyphenyl)propyl]-4aH-quinazolin-3-ium-4-one Traditional Name: 3-amino-2-[3-(2,4-dimethoxyphenyl)propyl]-4aH-quinazolin-3-ium-4-one Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CCCC2=[N+](C(=O)C3C=CC=CC3=N2)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CCCC2=[N+](C(=O)C3C=CC=CC3=N2)N)OC

InChI

InChI=1S/C19H22N3O3/c1-24-14-11-10-13(17(12-14)25-2)6-5-9-18-21-16-8-4-3-7-15(16)19(23)22(18)20/h3-4,7-8,10-12,15H,5-6,9,20H2,1-2H3/q+1