2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoic acid

Systemtic Name: 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoic acid Openeye Name: 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxo-butoxy]-4H-quinazolin-3-yl]acetic acid CAS Name: 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid IUPAC Name: 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid Traditional Name: 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-keto-butoxy]-4H-quinazolin-3-yl]acetic acid Formula: C23H32N4O5 MolecularWeight: 444.52398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(CN1CC(=O)O)C=C(C=C2)OCCCC(=O)N(C)C3CCCCC3

Isomeric SMILES

CC(=O)NC1=NC2=C(CN1CC(=O)O)C=C(C=C2)OCCCC(=O)N(C)C3CCCCC3

InChI

InChI=1S/C23H32N4O5/c1-16(28)24-23-25-20-11-10-19(13-17(20)14-27(23)15-22(30)31)32-12-6-9-21(29)26(2)18-7-4-3-5-8-18/h10-11,13,18H,3-9,12,14-15H2,1-2H3,(H,30,31)(H,24,25,28)