N-[(2-chloranyl-6-ethoxy-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)cyclohexanecarboxamide

Systemtic Name: N-[(2-chloranyl-6-ethoxy-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)cyclohexanecarboxamide Openeye Name: N-[(2-chloro-6-ethoxy-3-quinolyl)methyl]-N-(3-pyridylmethyl)cyclohexanecarboxamide CAS Name: N-[(2-chloro-6-ethoxy-3-quinolinyl)methyl]-N-(3-pyridinylmethyl)cyclohexanecarboxamide IUPAC Name: N-[(2-chloro-6-ethoxyquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)cyclohexanecarboxamide Traditional Name: N-[(2-chloro-6-ethoxy-3-quinolyl)methyl]-N-(3-pyridylmethyl)cyclohexanecarboxamide Formula: C25H28ClN3O2 MolecularWeight: 437.96172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C(N=C2C=C1)Cl)CN(CC3=CN=CC=C3)C(=O)C4CCCCC4

Isomeric SMILES

CCOC1=CC2=CC(=C(N=C2C=C1)Cl)CN(CC3=CN=CC=C3)C(=O)C4CCCCC4

InChI

InChI=1S/C25H28ClN3O2/c1-2-31-22-10-11-23-20(14-22)13-21(24(26)28-23)17-29(16-18-7-6-12-27-15-18)25(30)19-8-4-3-5-9-19/h6-7,10-15,19H,2-5,8-9,16-17H2,1H3