ethyl (2S)-2-[(4-methylphenyl)sulfonylamino]-2-[(1R)-2-oxidanylidenecycloheptyl]ethanoate

Systemtic Name: ethyl (2S)-2-[(4-methylphenyl)sulfonylamino]-2-[(1R)-2-oxidanylidenecycloheptyl]ethanoate Openeye Name: ethyl (2S)-2-[(1R)-2-oxocycloheptyl]-2-(p-tolylsulfonylamino)acetate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-2-[(1R)-2-oxocycloheptyl]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(4-methylphenyl)sulfonylamino]-2-[(1R)-2-oxocycloheptyl]acetate Traditional Name: (2S)-2-[(1R)-2-ketocycloheptyl]-2-(tosylamino)acetic acid ethyl ester Formula: C18H25NO5S MolecularWeight: 367.4598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CCCCCC1=O)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)[C@H]([C@H]1CCCCCC1=O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H25NO5S/c1-3-24-18(21)17(15-7-5-4-6-8-16(15)20)19-25(22,23)14-11-9-13(2)10-12-14/h9-12,15,17,19H,3-8H2,1-2H3/t15-,17-/m0/s1