[4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 2-propan-2-ylquinoline-4-carboxylate

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 2-propan-2-ylquinoline-4-carboxylate Openeye Name: [4-(2-methoxy-2-oxo-ethyl)phenyl] 2-isopropylquinoline-4-carboxylate CAS Name: 2-propan-2-yl-4-quinolinecarboxylic acid [4-(2-methoxy-2-oxoethyl)phenyl] ester IUPAC Name: [4-(2-methoxy-2-oxoethyl)phenyl] 2-propan-2-ylquinoline-4-carboxylate Traditional Name: 2-isopropylcinchoninic acid [4-(2-keto-2-methoxy-ethyl)phenyl] ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OC3=CC=C(C=C3)CC(=O)OC

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OC3=CC=C(C=C3)CC(=O)OC

InChI

InChI=1S/C22H21NO4/c1-14(2)20-13-18(17-6-4-5-7-19(17)23-20)22(25)27-16-10-8-15(9-11-16)12-21(24)26-3/h4-11,13-14H,12H2,1-3H3