3-chloranyl-1-oxidanylidene-2-propyl-isoquinoline-4-carbaldehyde

Systemtic Name: 3-chloranyl-1-oxidanylidene-2-propyl-isoquinoline-4-carbaldehyde Openeye Name: 3-chloro-1-oxo-2-propyl-isoquinoline-4-carbaldehyde CAS Name: 3-chloro-1-oxo-2-propyl-4-isoquinolinecarboxaldehyde IUPAC Name: 3-chloro-1-oxo-2-propylisoquinoline-4-carbaldehyde Traditional Name: 3-chloro-1-keto-2-propyl-isoquinoline-4-carbaldehyde Formula: C13H12ClNO2 MolecularWeight: 249.69288

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=CC=CC=C2C1=O)C=O)Cl

Isomeric SMILES

CCCN1C(=C(C2=CC=CC=C2C1=O)C=O)Cl

InChI

InChI=1S/C13H12ClNO2/c1-2-7-15-12(14)11(8-16)9-5-3-4-6-10(9)13(15)17/h3-6,8H,2,7H2,1H3