[4-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)phenyl]methyl-propyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: [4-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)phenyl]methyl-propyl-(pyridin-4-ylmethyl)azanium Openeye Name: [4-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)phenyl]methyl-propyl-(4-pyridylmethyl)ammonium CAS Name: [4-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)phenyl]methyl-propyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: [4-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)phenyl]methyl-propyl-(pyridin-4-ylmethyl)azanium Traditional Name: [4-(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)benzyl]-propyl-(4-pyridylmethyl)ammonium Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)CCCC3)CC4=CC=NC=C4

Isomeric SMILES

CCC[NH+](CC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)CCCC3)CC4=CC=NC=C4

InChI

InChI=1S/C24H28N4O/c1-2-15-28(17-19-11-13-25-14-12-19)16-18-7-9-20(10-8-18)23-26-22-6-4-3-5-21(22)24(29)27-23/h7-14H,2-6,15-17H2,1H3,(H,26,27,29)/p+1