[6-(3-azanylprop-1-ynyl)-6-chloranyl-cyclohexa-2,4-dien-1-yl]-(2-chlorophenyl)methanone

Systemtic Name: [6-(3-azanylprop-1-ynyl)-6-chloranyl-cyclohexa-2,4-dien-1-yl]-(2-chlorophenyl)methanone Openeye Name: [6-(3-aminoprop-1-ynyl)-6-chloro-cyclohexa-2,4-dien-1-yl]-(2-chlorophenyl)methanone CAS Name: [6-(3-aminoprop-1-ynyl)-6-chloro-1-cyclohexa-2,4-dienyl]-(2-chlorophenyl)methanone IUPAC Name: [6-(3-aminoprop-1-ynyl)-6-chlorocyclohexa-2,4-dien-1-yl]-(2-chlorophenyl)methanone Traditional Name: [6-(3-aminoprop-1-ynyl)-6-chloro-cyclohexa-2,4-dien-1-yl]-(2-chlorophenyl)methanone Formula: C16H13Cl2NO MolecularWeight: 306.18652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C2C=CC=CC2(C#CCN)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C2C=CC=CC2(C#CCN)Cl)Cl

InChI

InChI=1S/C16H13Cl2NO/c17-14-8-2-1-6-12(14)15(20)13-7-3-4-9-16(13,18)10-5-11-19/h1-4,6-9,13H,11,19H2