[2-(methylamino)-2-oxidanylidene-ethyl] 3-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propanoate

Systemtic Name: [2-(methylamino)-2-oxidanylidene-ethyl] 3-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propanoate Openeye Name: [2-(methylamino)-2-oxo-ethyl] 3-[4-oxo-3-(p-tolyl)quinazolin-2-yl]propanoate CAS Name: 3-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]propanoic acid [2-(methylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylamino)-2-oxoethyl] 3-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]propanoate Traditional Name: 3-[4-keto-3-(p-tolyl)quinazolin-2-yl]propionic acid [2-keto-2-(methylamino)ethyl] ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC(=O)OCC(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC(=O)OCC(=O)NC

InChI

InChI=1S/C21H21N3O4/c1-14-7-9-15(10-8-14)24-18(11-12-20(26)28-13-19(25)22-2)23-17-6-4-3-5-16(17)21(24)27/h3-10H,11-13H2,1-2H3,(H,22,25)