3-(8-chloranyl-2-oxidanylidene-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-6-yl)benzoic acid

Systemtic Name: 3-(8-chloranyl-2-oxidanylidene-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-6-yl)benzoic acid Openeye Name: 3-(8-chloro-2-oxo-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-6-yl)benzoic acid CAS Name: 3-(8-chloro-2-oxo-6-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]yl)benzoic acid IUPAC Name: 3-(8-chloro-2-oxospiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-6-yl)benzoic acid Traditional Name: 3-(8-chloro-2-keto-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-6-yl)benzoic acid Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3=C(C(=CC(=C3)C4=CC(=CC=C4)C(=O)O)Cl)NC(=O)N2

Isomeric SMILES

C1CCC2(CC1)C3=C(C(=CC(=C3)C4=CC(=CC=C4)C(=O)O)Cl)NC(=O)N2

InChI

InChI=1S/C20H19ClN2O3/c21-16-11-14(12-5-4-6-13(9-12)18(24)25)10-15-17(16)22-19(26)23-20(15)7-2-1-3-8-20/h4-6,9-11H,1-3,7-8H2,(H,24,25)(H2,22,23,26)