[(1S)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 2-azanyl-4-chloranyl-benzoate

Systemtic Name: [(1S)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 2-azanyl-4-chloranyl-benzoate Openeye Name: [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 2-amino-4-chloro-benzoate CAS Name: 2-amino-4-chlorobenzoic acid [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] ester IUPAC Name: [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 2-amino-4-chlorobenzoate Traditional Name: 2-amino-4-chloro-benzoic acid [(1S)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C17H14ClN3O3 MolecularWeight: 343.76436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=C(C=C(C=C3)Cl)N

Isomeric SMILES

C[C@@H](C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=C(C=C(C=C3)Cl)N

InChI

InChI=1S/C17H14ClN3O3/c1-9(24-17(23)11-7-6-10(18)8-13(11)19)15-20-14-5-3-2-4-12(14)16(22)21-15/h2-9H,19H2,1H3,(H,20,21,22)/t9-/m0/s1