N-(7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(5-keto-7,7-dimethyl-6,8-dihydroquinazolin-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=NC(=NC=C2C(=O)C1)NC(=O)C[NH+]3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1(CC2=NC(=NC=C2C(=O)C1)NC(=O)C[NH+]3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C21H24N4O2/c1-21(2)9-17-16(18(26)10-21)11-22-20(23-17)24-19(27)13-25-8-7-14-5-3-4-6-15(14)12-25/h3-6,11H,7-10,12-13H2,1-2H3,(H,22,23,24,27)/p+1