octan-3-yl 2-oxidanylidene-6-propan-2-yl-1H-quinoline-3-carboxylate

Systemtic Name: octan-3-yl 2-oxidanylidene-6-propan-2-yl-1H-quinoline-3-carboxylate Openeye Name: 1-ethylhexyl 6-isopropyl-2-oxo-1H-quinoline-3-carboxylate CAS Name: 2-oxo-6-propan-2-yl-1H-quinoline-3-carboxylic acid octan-3-yl ester IUPAC Name: octan-3-yl 2-oxo-6-propan-2-yl-1H-quinoline-3-carboxylate Traditional Name: 6-isopropyl-2-keto-1H-quinoline-3-carboxylic acid 1-ethylhexyl ester Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CC2=C(C=CC(=C2)C(C)C)NC1=O

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CC2=C(C=CC(=C2)C(C)C)NC1=O

InChI

InChI=1S/C21H29NO3/c1-5-7-8-9-17(6-2)25-21(24)18-13-16-12-15(14(3)4)10-11-19(16)22-20(18)23/h10-14,17H,5-9H2,1-4H3,(H,22,23)