N-[3-(azepan-1-ium-1-yl)propyl]-3-(3,4-dichlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide

Systemtic Name: N-[3-(azepan-1-ium-1-yl)propyl]-3-(3,4-dichlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: N-[3-(azepan-1-ium-1-yl)propyl]-3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide CAS Name: N-[3-(1-azepan-1-iumyl)propyl]-3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: N-[3-(azepan-1-ium-1-yl)propyl]-3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: N-[3-(azepan-1-ium-1-yl)propyl]-3-(3,4-dichlorophenyl)-4-hydroxy-2-keto-1H-quinazoline-4-carboxamide Formula: C24H29Cl2N4O3+ MolecularWeight: 492.41806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCNC(=O)C2(C3=CC=CC=C3NC(=O)N2C4=CC(=C(C=C4)Cl)Cl)O

Isomeric SMILES

C1CCC[NH+](CC1)CCCNC(=O)C2(C3=CC=CC=C3NC(=O)N2C4=CC(=C(C=C4)Cl)Cl)O

InChI

InChI=1S/C24H28Cl2N4O3/c25-19-11-10-17(16-20(19)26)30-23(32)28-21-9-4-3-8-18(21)24(30,33)22(31)27-12-7-15-29-13-5-1-2-6-14-29/h3-4,8-11,16,33H,1-2,5-7,12-15H2,(H,27,31)(H,28,32)/p+1