1-[(5S,7R)-5-(methylaminomethyl)-7-(4-methylphenyl)cyclohepten-1-yl]propan-1-one

Systemtic Name: 1-[(5S,7R)-5-(methylaminomethyl)-7-(4-methylphenyl)cyclohepten-1-yl]propan-1-one Openeye Name: 1-[(5S,7R)-5-(methylaminomethyl)-7-(p-tolyl)cyclohepten-1-yl]propan-1-one CAS Name: 1-[(5S,7R)-5-(methylaminomethyl)-7-(4-methylphenyl)-1-cycloheptenyl]-1-propanone IUPAC Name: 1-[(5S,7R)-5-(methylaminomethyl)-7-(4-methylphenyl)cyclohepten-1-yl]propan-1-one Traditional Name: 1-[(5S,7R)-5-(methylaminomethyl)-7-(p-tolyl)cyclohepten-1-yl]propan-1-one Formula: C19H27NO MolecularWeight: 285.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CCCC(CC1C2=CC=C(C=C2)C)CNC

Isomeric SMILES

CCC(=O)C1=CCC[C@@H](C[C@@H]1C2=CC=C(C=C2)C)CNC

InChI

InChI=1S/C19H27NO/c1-4-19(21)17-7-5-6-15(13-20-3)12-18(17)16-10-8-14(2)9-11-16/h7-11,15,18,20H,4-6,12-13H2,1-3H3/t15-,18+/m0/s1