methyl 3-[2-(phenylsulfonylamino)ethyl]-6-propan-2-yl-azulene-1-carboxylate

Systemtic Name: methyl 3-[2-(phenylsulfonylamino)ethyl]-6-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-[2-(benzenesulfonamido)ethyl]-6-isopropyl-azulene-1-carboxylate CAS Name: 3-[2-(benzenesulfonamido)ethyl]-6-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(benzenesulfonamido)ethyl]-6-propan-2-ylazulene-1-carboxylate Traditional Name: 3-[2-(benzenesulfonamido)ethyl]-6-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C2C(=C(C=C2CCNS(=O)(=O)C3=CC=CC=C3)C(=O)OC)C=C1

Isomeric SMILES

CC(C)C1=CC=C2C(=C(C=C2CCNS(=O)(=O)C3=CC=CC=C3)C(=O)OC)C=C1

InChI

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