dimethyl-[(2R)-2-[4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoylamino]-2-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(2R)-2-[4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoylamino]-2-phenyl-ethyl]azanium Openeye Name: dimethyl-[(2R)-2-[4-(8-methyl-4-oxo-quinazolin-3-yl)butanoylamino]-2-phenyl-ethyl]ammonium CAS Name: dimethyl-[(2R)-2-[[4-(8-methyl-4-oxo-3-quinazolinyl)-1-oxobutyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2R)-2-[4-(8-methyl-4-oxoquinazolin-3-yl)butanoylamino]-2-phenylethyl]azanium Traditional Name: [(2R)-2-[4-(4-keto-8-methyl-quinazolin-3-yl)butanoylamino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NC(C[NH+](C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)N[C@@H](C[NH+](C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H28N4O2/c1-17-9-7-12-19-22(17)24-16-27(23(19)29)14-8-13-21(28)25-20(15-26(2)3)18-10-5-4-6-11-18/h4-7,9-12,16,20H,8,13-15H2,1-3H3,(H,25,28)/p+1/t20-/m0/s1