5-(2-chlorophenyl)-2-(3-oxidanylpropyliminomethyl)cyclohexane-1,3-dione

Systemtic Name: 5-(2-chlorophenyl)-2-(3-oxidanylpropyliminomethyl)cyclohexane-1,3-dione Openeye Name: 5-(2-chlorophenyl)-2-(3-hydroxypropyliminomethyl)cyclohexane-1,3-dione CAS Name: 5-(2-chlorophenyl)-2-(3-hydroxypropyliminomethyl)cyclohexane-1,3-dione IUPAC Name: 5-(2-chlorophenyl)-2-(3-hydroxypropyliminomethyl)cyclohexane-1,3-dione Traditional Name: 5-(2-chlorophenyl)-2-(3-hydroxypropyliminomethyl)cyclohexane-1,3-quinone Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(C1=O)C=NCCCO)C2=CC=CC=C2Cl

Isomeric SMILES

C1C(CC(=O)C(C1=O)C=NCCCO)C2=CC=CC=C2Cl

InChI

InChI=1S/C16H18ClNO3/c17-14-5-2-1-4-12(14)11-8-15(20)13(16(21)9-11)10-18-6-3-7-19/h1-2,4-5,10-11,13,19H,3,6-9H2