(3S)-1-(4-acetamidophenyl)sulfonyl-N-cycloheptyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-cycloheptyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-cycloheptyl-piperidine-3-carboxamide CAS Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-cycloheptyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-cycloheptylpiperidine-3-carboxamide Traditional Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-cycloheptyl-nipecotamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3CCCCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)NC3CCCCCC3

InChI

InChI=1S/C21H31N3O4S/c1-16(25)22-19-10-12-20(13-11-19)29(27,28)24-14-6-7-17(15-24)21(26)23-18-8-4-2-3-5-9-18/h10-13,17-18H,2-9,14-15H2,1H3,(H,22,25)(H,23,26)/t17-/m0/s1