ethyl 4-(azepan-1-yl)-6-ethoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 4-(azepan-1-yl)-6-ethoxy-quinoline-3-carboxylate Openeye Name: ethyl 4-(azepan-1-yl)-6-ethoxy-quinoline-3-carboxylate CAS Name: 4-(1-azepanyl)-6-ethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(azepan-1-yl)-6-ethoxyquinoline-3-carboxylate Traditional Name: 4-(azepan-1-yl)-6-ethoxy-quinoline-3-carboxylic acid ethyl ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)N3CCCCCC3

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)N3CCCCCC3

InChI

InChI=1S/C20H26N2O3/c1-3-24-15-9-10-18-16(13-15)19(22-11-7-5-6-8-12-22)17(14-21-18)20(23)25-4-2/h9-10,13-14H,3-8,11-12H2,1-2H3