4-[[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[(2S)-2-(4-ketoquinazolin-3-yl)propanoyl]amino]methyl]cyclohexanecarboxylate Formula: C19H22N3O4- MolecularWeight: 356.39568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCC(CC1)C(=O)[O-])N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C[C@@H](C(=O)NCC1CCC(CC1)C(=O)[O-])N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H23N3O4/c1-12(22-11-21-16-5-3-2-4-15(16)18(22)24)17(23)20-10-13-6-8-14(9-7-13)19(25)26/h2-5,11-14H,6-10H2,1H3,(H,20,23)(H,25,26)/p-1/t12-,13?,14?/m0/s1