2-[(4-chlorophenyl)-deuterio-amino]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[(4-chlorophenyl)-deuterio-amino]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-(4-chloro-N-deuterio-anilino)cyclohepta-2,4,6-trien-1-one CAS Name: 2-(4-chloro-N-deuterioanilino)-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-(4-chloro-N-deuterioanilino)cyclohepta-2,4,6-trien-1-one Traditional Name: 2-(4-chloro-N-deuterio-anilino)cyclohepta-2,4,6-trien-1-one Formula: C13H10ClNO MolecularWeight: 232.683762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=O)C=C1)NC2=CC=C(C=C2)Cl

Isomeric SMILES

[2H]N(C1=CC=C(C=C1)Cl)C2=CC=CC=CC2=O

InChI

InChI=1S/C13H10ClNO/c14-10-6-8-11(9-7-10)15-12-4-2-1-3-5-13(12)16/h1-9H,(H,15,16)/i/hD