3-(8-chloranyl-2-oxidanylidene-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-5-yl)oxycyclobutane-1-carboxylic acid

Systemtic Name: 3-(8-chloranyl-2-oxidanylidene-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-5-yl)oxycyclobutane-1-carboxylic acid Openeye Name: 3-(8-chloro-2-oxo-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-5-yl)oxycyclobutanecarboxylic acid CAS Name: 3-[(8-chloro-2-oxo-5-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]yl)oxy]-1-cyclobutanecarboxylic acid IUPAC Name: 3-(8-chloro-2-oxospiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-5-yl)oxycyclobutane-1-carboxylic acid Traditional Name: 3-(8-chloro-2-keto-spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-5-yl)oxycyclobutanecarboxylic acid Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3=C(C=CC(=C3NC(=O)N2)Cl)OC4CC(C4)C(=O)O

Isomeric SMILES

C1CCC2(CC1)C3=C(C=CC(=C3NC(=O)N2)Cl)OC4CC(C4)C(=O)O

InChI

InChI=1S/C18H21ClN2O4/c19-12-4-5-13(25-11-8-10(9-11)16(22)23)14-15(12)20-17(24)21-18(14)6-2-1-3-7-18/h4-5,10-11H,1-3,6-9H2,(H,22,23)(H2,20,21,24)