(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2-methyl-5-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 2-methyl-5-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 2-methyl-5-(2-methylpiperidino)sulfonyl-benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C22H26N2O5S/c1-15-11-12-18(30(27,28)24-13-7-6-8-16(24)2)14-19(15)22(26)29-20(21(23)25)17-9-4-3-5-10-17/h3-5,9-12,14,16,20H,6-8,13H2,1-2H3,(H2,23,25)