4-[[2,3-bis(chloranyl)phenyl]methylamino]-8-ethyl-3-(hydroxymethyl)quinoline-6-carbonitrile

Systemtic Name: 4-[[2,3-bis(chloranyl)phenyl]methylamino]-8-ethyl-3-(hydroxymethyl)quinoline-6-carbonitrile Openeye Name: 4-[(2,3-dichlorophenyl)methylamino]-8-ethyl-3-(hydroxymethyl)quinoline-6-carbonitrile CAS Name: 4-[(2,3-dichlorophenyl)methylamino]-8-ethyl-3-(hydroxymethyl)-6-quinolinecarbonitrile IUPAC Name: 4-[(2,3-dichlorophenyl)methylamino]-8-ethyl-3-(hydroxymethyl)quinoline-6-carbonitrile Traditional Name: 4-[(2,3-dichlorobenzyl)amino]-8-ethyl-3-methylol-quinoline-6-carbonitrile Formula: C20H17Cl2N3O MolecularWeight: 386.27448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC2=C(C(=CN=C12)CO)NCC3=C(C(=CC=C3)Cl)Cl)C#N

Isomeric SMILES

CCC1=CC(=CC2=C(C(=CN=C12)CO)NCC3=C(C(=CC=C3)Cl)Cl)C#N

InChI

InChI=1S/C20H17Cl2N3O/c1-2-13-6-12(8-23)7-16-19(13)25-10-15(11-26)20(16)24-9-14-4-3-5-17(21)18(14)22/h3-7,10,26H,2,9,11H2,1H3,(H,24,25)