2-[3-[4-(phenylsulfonylamino)butyl]-6-propan-2-yl-azulen-1-yl]ethanoic acid

Systemtic Name: 2-[3-[4-(phenylsulfonylamino)butyl]-6-propan-2-yl-azulen-1-yl]ethanoic acid Openeye Name: 2-[3-[4-(benzenesulfonamido)butyl]-6-isopropyl-azulen-1-yl]acetic acid CAS Name: 2-[3-[4-(benzenesulfonamido)butyl]-6-propan-2-yl-1-azulenyl]acetic acid IUPAC Name: 2-[3-[4-(benzenesulfonamido)butyl]-6-propan-2-ylazulen-1-yl]acetic acid Traditional Name: 2-[3-[4-(benzenesulfonamido)butyl]-6-isopropyl-azulen-1-yl]acetic acid Formula: C25H29NO4S MolecularWeight: 439.56706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C2C(=C(C=C2CCCCNS(=O)(=O)C3=CC=CC=C3)CC(=O)O)C=C1

Isomeric SMILES

CC(C)C1=CC=C2C(=C(C=C2CCCCNS(=O)(=O)C3=CC=CC=C3)CC(=O)O)C=C1

InChI

InChI=1S/C25H29NO4S/c1-18(2)19-11-13-23-20(16-21(17-25(27)28)24(23)14-12-19)8-6-7-15-26-31(29,30)22-9-4-3-5-10-22/h3-5,9-14,16,18,26H,6-8,15,17H2,1-2H3,(H,27,28)