2-[(3-bromanyl-4-chloranyl-2-methyl-quinolin-6-yl)methyl-prop-2-ynyl-amino]benzaldehyde

Systemtic Name: 2-[(3-bromanyl-4-chloranyl-2-methyl-quinolin-6-yl)methyl-prop-2-ynyl-amino]benzaldehyde Openeye Name: 2-[(3-bromo-4-chloro-2-methyl-6-quinolyl)methyl-prop-2-ynyl-amino]benzaldehyde CAS Name: 2-[(3-bromo-4-chloro-2-methyl-6-quinolinyl)methyl-prop-2-ynylamino]benzaldehyde IUPAC Name: 2-[(3-bromo-4-chloro-2-methylquinolin-6-yl)methyl-prop-2-ynylamino]benzaldehyde Traditional Name: 2-[(3-bromo-4-chloro-2-methyl-6-quinolyl)methyl-propargyl-amino]benzaldehyde Formula: C21H16BrClN2O MolecularWeight: 427.72154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)CN(CC#C)C3=CC=CC=C3C=O)C(=C1Br)Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)CN(CC#C)C3=CC=CC=C3C=O)C(=C1Br)Cl

InChI

InChI=1S/C21H16BrClN2O/c1-3-10-25(19-7-5-4-6-16(19)13-26)12-15-8-9-18-17(11-15)21(23)20(22)14(2)24-18/h1,4-9,11,13H,10,12H2,2H3