2-[(2,5-dimethylphenyl)sulfonylamino]-3-(1-methylindol-3-yl)propanoic acid

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-3-(1-methylindol-3-yl)propanoic acid Openeye Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-3-(1-methylindol-3-yl)propanoic acid CAS Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-3-(1-methyl-3-indolyl)propanoic acid IUPAC Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-3-(1-methylindol-3-yl)propanoic acid Traditional Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-3-(1-methylindol-3-yl)propionic acid Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(CC2=CN(C3=CC=CC=C32)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(CC2=CN(C3=CC=CC=C32)C)C(=O)O

InChI

InChI=1S/C20H22N2O4S/c1-13-8-9-14(2)19(10-13)27(25,26)21-17(20(23)24)11-15-12-22(3)18-7-5-4-6-16(15)18/h4-10,12,17,21H,11H2,1-3H3,(H,23,24)