N-[1-(1-azanyl-3-oxidanyl-piperidin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[1-(1-azanyl-3-oxidanyl-piperidin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[1-(1-amino-3-hydroxy-piperidine-2-carbonyl)-3-methyl-butyl]naphthalene-2-sulfonamide CAS Name: N-[1-(1-amino-3-hydroxy-2-piperidinyl)-4-methyl-1-oxopentan-2-yl]-2-naphthalenesulfonamide IUPAC Name: N-[1-(1-amino-3-hydroxypiperidin-2-yl)-4-methyl-1-oxopentan-2-yl]naphthalene-2-sulfonamide Traditional Name: N-[1-(1-amino-3-hydroxy-pipecoloyl)-3-methyl-butyl]naphthalene-2-sulfonamide Formula: C21H29N3O4S MolecularWeight: 419.53766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C1C(CCCN1N)O)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)CC(C(=O)C1C(CCCN1N)O)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H29N3O4S/c1-14(2)12-18(21(26)20-19(25)8-5-11-24(20)22)23-29(27,28)17-10-9-15-6-3-4-7-16(15)13-17/h3-4,6-7,9-10,13-14,18-20,23,25H,5,8,11-12,22H2,1-2H3