2-[[2-chloranyl-3-(hydroxymethyl)quinolin-6-yl]methyl-prop-2-ynyl-amino]benzaldehyde

Systemtic Name: 2-[[2-chloranyl-3-(hydroxymethyl)quinolin-6-yl]methyl-prop-2-ynyl-amino]benzaldehyde Openeye Name: 2-[[2-chloro-3-(hydroxymethyl)-6-quinolyl]methyl-prop-2-ynyl-amino]benzaldehyde CAS Name: 2-[[2-chloro-3-(hydroxymethyl)-6-quinolinyl]methyl-prop-2-ynylamino]benzaldehyde IUPAC Name: 2-[[2-chloro-3-(hydroxymethyl)quinolin-6-yl]methyl-prop-2-ynylamino]benzaldehyde Traditional Name: 2-[(2-chloro-3-methylol-6-quinolyl)methyl-propargyl-amino]benzaldehyde Formula: C21H17ClN2O2 MolecularWeight: 364.82488

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC1=CC2=CC(=C(N=C2C=C1)Cl)CO)C3=CC=CC=C3C=O

Isomeric SMILES

C#CCN(CC1=CC2=CC(=C(N=C2C=C1)Cl)CO)C3=CC=CC=C3C=O

InChI

InChI=1S/C21H17ClN2O2/c1-2-9-24(20-6-4-3-5-16(20)13-25)12-15-7-8-19-17(10-15)11-18(14-26)21(22)23-19/h1,3-8,10-11,13,26H,9,12,14H2