2-diethylaminoethyl 1-(3-methylbutyl)-2-oxidanylidene-quinoline-4-carboxylate

Systemtic Name: 2-diethylaminoethyl 1-(3-methylbutyl)-2-oxidanylidene-quinoline-4-carboxylate Openeye Name: 2-diethylaminoethyl 1-isopentyl-2-oxo-quinoline-4-carboxylate CAS Name: 1-(3-methylbutyl)-2-oxo-4-quinolinecarboxylic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 1-(3-methylbutyl)-2-oxoquinoline-4-carboxylate Traditional Name: 1-isoamyl-2-keto-cinchoninic acid 2-diethylaminoethyl ester Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC(=O)N(C2=CC=CC=C21)CCC(C)C

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC(=O)N(C2=CC=CC=C21)CCC(C)C

InChI

InChI=1S/C21H30N2O3/c1-5-22(6-2)13-14-26-21(25)18-15-20(24)23(12-11-16(3)4)19-10-8-7-9-17(18)19/h7-10,15-16H,5-6,11-14H2,1-4H3