(E)-[(4R)-4-(3-chlorophenyl)-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl]methylidene-cyclopentyl-azanium

Systemtic Name: (E)-[(4R)-4-(3-chlorophenyl)-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl]methylidene-cyclopentyl-azanium Openeye Name: (E)-[(4R)-4-(3-chlorophenyl)-2-hydroxy-6-oxo-cyclohexen-1-yl]methylene-cyclopentyl-ammonium CAS Name: (E)-[(4R)-4-(3-chlorophenyl)-2-hydroxy-6-oxo-1-cyclohexenyl]methylidene-cyclopentylammonium IUPAC Name: (E)-[(4R)-4-(3-chlorophenyl)-2-hydroxy-6-oxocyclohexen-1-yl]methylidene-cyclopentylazanium Traditional Name: (E)-[(4R)-4-(3-chlorophenyl)-2-hydroxy-6-keto-cyclohexen-1-yl]methylene-cyclopentyl-ammonium Formula: C18H21ClNO2+ MolecularWeight: 318.81784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]=CC2=C(CC(CC2=O)C3=CC(=CC=C3)Cl)O

Isomeric SMILES

C1CCC(C1)/[NH+]=C/C2=C(C[C@H](CC2=O)C3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C18H20ClNO2/c19-14-5-3-4-12(8-14)13-9-17(21)16(18(22)10-13)11-20-15-6-1-2-7-15/h3-5,8,11,13,15,21H,1-2,6-7,9-10H2/p+1/b20-11+/t13-/m1/s1