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

Systemtic Name: 3-(8-chloranyl-2-oxidanylidene-spiro[1,3-dihydroquinazoline-4,1'-cycloheptane]-5-yl)oxycyclobutane-1-carboxylic acid Openeye Name: 3-(8-chloro-2-oxo-spiro[1,3-dihydroquinazoline-4,1'-cycloheptane]-5-yl)oxycyclobutanecarboxylic acid CAS Name: 3-[(8-chloro-2-oxo-5-spiro[1,3-dihydroquinazoline-4,1'-cycloheptane]yl)oxy]-1-cyclobutanecarboxylic acid IUPAC Name: 3-(8-chloro-2-oxospiro[1,3-dihydroquinazoline-4,1'-cycloheptane]-5-yl)oxycyclobutane-1-carboxylic acid Traditional Name: 3-(8-chloro-2-keto-spiro[1,3-dihydroquinazoline-4,1'-cycloheptane]-5-yl)oxycyclobutanecarboxylic acid Formula: C19H23ClN2O4 MolecularWeight: 378.84992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)C3=C(C=CC(=C3NC(=O)N2)Cl)OC4CC(C4)C(=O)O

Isomeric SMILES

C1CCCC2(CC1)C3=C(C=CC(=C3NC(=O)N2)Cl)OC4CC(C4)C(=O)O

InChI

InChI=1S/C19H23ClN2O4/c20-13-5-6-14(26-12-9-11(10-12)17(23)24)15-16(13)21-18(25)22-19(15)7-3-1-2-4-8-19/h5-6,11-12H,1-4,7-10H2,(H,23,24)(H2,21,22,25)