[2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(4-oxidanylidenequinazolin-3-yl)ethanoate

Systemtic Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(4-oxidanylidenequinazolin-3-yl)ethanoate Openeye Name: [2-[[(1S)-1-methylhexyl]amino]-2-oxo-ethyl] 2-(4-oxoquinazolin-3-yl)acetate CAS Name: 2-(4-oxo-3-quinazolinyl)acetic acid [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] 2-(4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-ketoquinazolin-3-yl)acetic acid [2-keto-2-[[(1S)-1-methylhexyl]amino]ethyl] ester Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)COC(=O)CN1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CCCCC[C@H](C)NC(=O)COC(=O)CN1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C19H25N3O4/c1-3-4-5-8-14(2)21-17(23)12-26-18(24)11-22-13-20-16-10-7-6-9-15(16)19(22)25/h6-7,9-10,13-14H,3-5,8,11-12H2,1-2H3,(H,21,23)/t14-/m0/s1