methyl 3-[2-(phenylsulfonylamino)ethyl]-7-propan-2-yl-azulene-1-carboxylate

Systemtic Name: methyl 3-[2-(phenylsulfonylamino)ethyl]-7-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-[2-(benzenesulfonamido)ethyl]-7-isopropyl-azulene-1-carboxylate CAS Name: 3-[2-(benzenesulfonamido)ethyl]-7-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(benzenesulfonamido)ethyl]-7-propan-2-ylazulene-1-carboxylate Traditional Name: 3-[2-(benzenesulfonamido)ethyl]-7-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C23H25NO4S MolecularWeight: 411.5139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25NO4S/c1-16(2)17-8-7-11-20-18(15-22(21(20)14-17)23(25)28-3)12-13-24-29(26,27)19-9-5-4-6-10-19/h4-11,14-16,24H,12-13H2,1-3H3