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

Systemtic Name: 3-[(2-azanyl-4-chloranyl-quinolin-6-yl)methyl-prop-2-ynyl-amino]-2-fluoranyl-benzaldehyde Openeye Name: 3-[(2-amino-4-chloro-6-quinolyl)methyl-prop-2-ynyl-amino]-2-fluoro-benzaldehyde CAS Name: 3-[(2-amino-4-chloro-6-quinolinyl)methyl-prop-2-ynylamino]-2-fluorobenzaldehyde IUPAC Name: 3-[(2-amino-4-chloroquinolin-6-yl)methyl-prop-2-ynylamino]-2-fluorobenzaldehyde Traditional Name: 3-[(2-amino-4-chloro-6-quinolyl)methyl-propargyl-amino]-2-fluoro-benzaldehyde Formula: C20H15ClFN3O MolecularWeight: 367.804003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC1=CC2=C(C=C1)N=C(C=C2Cl)N)C3=CC=CC(=C3F)C=O

Isomeric SMILES

C#CCN(CC1=CC2=C(C=C1)N=C(C=C2Cl)N)C3=CC=CC(=C3F)C=O

InChI

InChI=1S/C20H15ClFN3O/c1-2-8-25(18-5-3-4-14(12-26)20(18)22)11-13-6-7-17-15(9-13)16(21)10-19(23)24-17/h1,3-7,9-10,12H,8,11H2,(H2,23,24)