3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2-methyl-indol-1-yl]propanoic acid

Systemtic Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2-methyl-indol-1-yl]propanoic acid Openeye Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2-methyl-indol-1-yl]propanoic acid CAS Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2-methyl-1-indolyl]propanoic acid IUPAC Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2-methylindol-1-yl]propanoic acid Traditional Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2-methyl-indol-1-yl]propionic acid Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CCC(=O)O)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CCC(=O)O)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O4S/c1-14-17(10-12-22-28(26,27)16-8-6-15(21)7-9-16)18-4-2-3-5-19(18)23(14)13-11-20(24)25/h2-9,22H,10-13H2,1H3,(H,24,25)