1-[(2S)-2-azanyl-2-(3,4-dimethylphenyl)ethyl]azocan-2-one

Systemtic Name: 1-[(2S)-2-azanyl-2-(3,4-dimethylphenyl)ethyl]azocan-2-one Openeye Name: 1-[(2S)-2-amino-2-(3,4-dimethylphenyl)ethyl]azocan-2-one CAS Name: 1-[(2S)-2-amino-2-(3,4-dimethylphenyl)ethyl]-2-azocanone IUPAC Name: 1-[(2S)-2-amino-2-(3,4-dimethylphenyl)ethyl]azocan-2-one Traditional Name: 1-[(2S)-2-amino-2-(3,4-dimethylphenyl)ethyl]azocan-2-one Formula: C17H26N2O MolecularWeight: 274.40114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CN2CCCCCCC2=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](CN2CCCCCCC2=O)N)C

InChI

InChI=1S/C17H26N2O/c1-13-8-9-15(11-14(13)2)16(18)12-19-10-6-4-3-5-7-17(19)20/h8-9,11,16H,3-7,10,12,18H2,1-2H3/t16-/m1/s1