(E)-4-(2-chloranyl-7-methoxy-quinolin-3-yl)but-3-en-2-one

Systemtic Name: (E)-4-(2-chloranyl-7-methoxy-quinolin-3-yl)but-3-en-2-one Openeye Name: (E)-4-(2-chloro-7-methoxy-3-quinolyl)but-3-en-2-one CAS Name: (E)-4-(2-chloro-7-methoxy-3-quinolinyl)-3-buten-2-one IUPAC Name: (E)-4-(2-chloro-7-methoxyquinolin-3-yl)but-3-en-2-one Traditional Name: (E)-4-(2-chloro-7-methoxy-3-quinolyl)but-3-en-2-one Formula: C14H12ClNO2 MolecularWeight: 261.70358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=C(N=C2C=C(C=CC2=C1)OC)Cl

Isomeric SMILES

CC(=O)/C=C/C1=C(N=C2C=C(C=CC2=C1)OC)Cl

InChI

InChI=1S/C14H12ClNO2/c1-9(17)3-4-11-7-10-5-6-12(18-2)8-13(10)16-14(11)15/h3-8H,1-2H3/b4-3+