3-[4-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoyl]amino]phenyl]propanoic acid

Systemtic Name: 3-[4-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoyl]amino]phenyl]propanoic acid Openeye Name: 3-[4-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoyl]amino]phenyl]propanoic acid CAS Name: 3-[4-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoyl]amino]phenyl]propanoic acid Traditional Name: 3-[4-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoyl]amino]phenyl]propionic acid Formula: C26H24ClN3O5S MolecularWeight: 526.00386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NC3=CC=C(C=C3)CCC(=O)O)NS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NC3=CC=C(C=C3)CCC(=O)O)NS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H24ClN3O5S/c27-19-8-12-21(13-9-19)36(34,35)30-24(15-18-16-28-23-4-2-1-3-22(18)23)26(33)29-20-10-5-17(6-11-20)7-14-25(31)32/h1-6,8-13,16,24,28,30H,7,14-15H2,(H,29,33)(H,31,32)