diethyl-[2-[[3-(3-methoxyphenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]ethyl]azanium

Systemtic Name: diethyl-[2-[[3-(3-methoxyphenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]ethyl]azanium Openeye Name: diethyl-[2-[[4-hydroxy-3-(3-methoxyphenyl)-2-oxo-1H-quinazoline-4-carbonyl]amino]ethyl]ammonium CAS Name: diethyl-[2-[[[4-hydroxy-3-(3-methoxyphenyl)-2-oxo-1H-quinazolin-4-yl]-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[[4-hydroxy-3-(3-methoxyphenyl)-2-oxo-1H-quinazoline-4-carbonyl]amino]ethyl]azanium Traditional Name: diethyl-[2-[[4-hydroxy-2-keto-3-(3-methoxyphenyl)-1H-quinazoline-4-carbonyl]amino]ethyl]ammonium Formula: C22H29N4O4+ MolecularWeight: 413.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1(C2=CC=CC=C2NC(=O)N1C3=CC(=CC=C3)OC)O

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1(C2=CC=CC=C2NC(=O)N1C3=CC(=CC=C3)OC)O

InChI

InChI=1S/C22H28N4O4/c1-4-25(5-2)14-13-23-20(27)22(29)18-11-6-7-12-19(18)24-21(28)26(22)16-9-8-10-17(15-16)30-3/h6-12,15,29H,4-5,13-14H2,1-3H3,(H,23,27)(H,24,28)/p+1