3-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-phenyl-propan-1-one chloride

Systemtic Name: 3-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-phenyl-propan-1-one chloride Openeye Name: 3-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-phenyl-propan-1-one chloride CAS Name: 3-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-phenyl-1-propanone chloride IUPAC Name: 3-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-phenylpropan-1-one chloride Traditional Name: 3-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-phenyl-propan-1-one chloride Formula: C17H21ClNO- MolecularWeight: 290.80774

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1CN(C2)CCC(=O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1C=CCC2C1CN(C2)CCC(=O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C17H21NO.ClH/c19-17(14-6-2-1-3-7-14)10-11-18-12-15-8-4-5-9-16(15)13-18;/h1-7,15-16H,8-13H2;1H/p-1