5-(3-chlorophenyl)-2-[(3-oxidanylpropylamino)methylidene]cyclohexane-1,3-dione

Systemtic Name: 5-(3-chlorophenyl)-2-[(3-oxidanylpropylamino)methylidene]cyclohexane-1,3-dione Openeye Name: 5-(3-chlorophenyl)-2-[(3-hydroxypropylamino)methylene]cyclohexane-1,3-dione CAS Name: 5-(3-chlorophenyl)-2-[(3-hydroxypropylamino)methylidene]cyclohexane-1,3-dione IUPAC Name: 5-(3-chlorophenyl)-2-[(3-hydroxypropylamino)methylidene]cyclohexane-1,3-dione Traditional Name: 5-(3-chlorophenyl)-2-[(3-hydroxypropylamino)methylene]cyclohexane-1,3-quinone Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(=CNCCCO)C1=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

C1C(CC(=O)C(=CNCCCO)C1=O)C2=CC(=CC=C2)Cl

InChI

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