methyl 4-[[methyl-[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanoyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanoyl]amino]methyl]benzoate Openeye Name: methyl 4-[[methyl-[4-(2-methyl-4-oxo-quinazolin-3-yl)butanoyl]amino]methyl]benzoate CAS Name: 4-[[methyl-[4-(2-methyl-4-oxo-3-quinazolinyl)-1-oxobutyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-[4-(2-methyl-4-oxoquinazolin-3-yl)butanoyl]amino]methyl]benzoate Traditional Name: 4-[[4-(4-keto-2-methyl-quinazolin-3-yl)butanoyl-methyl-amino]methyl]benzoic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)N(C)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)N(C)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H25N3O4/c1-16-24-20-8-5-4-7-19(20)22(28)26(16)14-6-9-21(27)25(2)15-17-10-12-18(13-11-17)23(29)30-3/h4-5,7-8,10-13H,6,9,14-15H2,1-3H3