N-[3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]butan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]butan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[1-(4-benzylpiperidine-1-carbonyl)-2-methyl-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-methyl-1-oxo-1-[4-(phenylmethyl)-1-piperidinyl]butan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[1-(4-benzylpiperidine-1-carbonyl)-2-methyl-propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C26H34N2O5S MolecularWeight: 486.62356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(C)C(C(=O)N1CCC(CC1)CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C26H34N2O5S/c1-19(2)25(26(29)28-13-11-21(12-14-28)17-20-7-4-3-5-8-20)27-34(30,31)22-9-10-23-24(18-22)33-16-6-15-32-23/h3-5,7-10,18-19,21,25,27H,6,11-17H2,1-2H3