[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-ethyl-azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-ethyl-azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-ethyl-ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-ethylammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-ethylazanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-ethyl-ammonium Formula: C19H26ClN4O2+ MolecularWeight: 377.88834

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)N3CCCCCC3

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)N3CCCCCC3

InChI

InChI=1S/C19H25ClN4O2/c1-2-23(13-18(25)24-9-5-3-4-6-10-24)12-17-21-16-11-14(20)7-8-15(16)19(26)22-17/h7-8,11H,2-6,9-10,12-13H2,1H3,(H,21,22,26)/p+1