N-(4-ethoxyphenyl)-4-[(3S)-3-methylpiperidin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[(3S)-3-methylpiperidin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(4-ethoxyphenyl)-4-[(3S)-3-methylpiperidine-1-carbonyl]benzenesulfonamide CAS Name: N-(4-ethoxyphenyl)-4-[[(3S)-3-methyl-1-piperidinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-(4-ethoxyphenyl)-4-[(3S)-3-methylpiperidine-1-carbonyl]benzenesulfonamide Traditional Name: 4-[(3S)-3-methylpiperidine-1-carbonyl]-N-p-phenetyl-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCC(C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC[C@@H](C3)C

InChI

InChI=1S/C21H26N2O4S/c1-3-27-19-10-8-18(9-11-19)22-28(25,26)20-12-6-17(7-13-20)21(24)23-14-4-5-16(2)15-23/h6-13,16,22H,3-5,14-15H2,1-2H3/t16-/m0/s1