(2S)-2-[(S)-(naphthalen-2-ylamino)-pyridin-3-yl-methyl]cyclohexan-1-one

Systemtic Name: (2S)-2-[(S)-(naphthalen-2-ylamino)-pyridin-3-yl-methyl]cyclohexan-1-one Openeye Name: (2S)-2-[(S)-(2-naphthylamino)-(3-pyridyl)methyl]cyclohexanone CAS Name: (2S)-2-[(S)-(2-naphthalenylamino)-(3-pyridinyl)methyl]-1-cyclohexanone IUPAC Name: (2S)-2-[(S)-(naphthalen-2-ylamino)-pyridin-3-ylmethyl]cyclohexan-1-one Traditional Name: (2S)-2-[(S)-(2-naphthylamino)-(3-pyridyl)methyl]cyclohexanone Formula: C22H22N2O MolecularWeight: 330.42288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)C(C2=CN=CC=C2)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCC(=O)[C@@H](C1)[C@@H](C2=CN=CC=C2)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H22N2O/c25-21-10-4-3-9-20(21)22(18-8-5-13-23-15-18)24-19-12-11-16-6-1-2-7-17(16)14-19/h1-2,5-8,11-15,20,22,24H,3-4,9-10H2/t20-,22-/m1/s1