ethyl 6-butyl-4-(8-methylnonoxy)-3-propyl-quinoline-2-carboxylate

Systemtic Name: ethyl 6-butyl-4-(8-methylnonoxy)-3-propyl-quinoline-2-carboxylate Openeye Name: ethyl 6-butyl-4-(8-methylnonoxy)-3-propyl-quinoline-2-carboxylate CAS Name: 6-butyl-4-(8-methylnonoxy)-3-propyl-2-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-butyl-4-(8-methylnonoxy)-3-propylquinoline-2-carboxylate Traditional Name: 6-butyl-4-(8-methylnonoxy)-3-propyl-quinaldic acid ethyl ester Formula: C29H45NO3 MolecularWeight: 455.6725

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(C(=C2OCCCCCCCC(C)C)CCC)C(=O)OCC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(C(=C2OCCCCCCCC(C)C)CCC)C(=O)OCC

InChI

InChI=1S/C29H45NO3/c1-6-9-17-23-18-19-26-25(21-23)28(33-20-14-12-10-11-13-16-22(4)5)24(15-7-2)27(30-26)29(31)32-8-3/h18-19,21-22H,6-17,20H2,1-5H3