2-[(4-phenylphenyl)sulfonylamino]-6-pyrrolidin-1-yl-hex-4-ynoic acid

Systemtic Name: 2-[(4-phenylphenyl)sulfonylamino]-6-pyrrolidin-1-yl-hex-4-ynoic acid Openeye Name: 2-[(4-phenylphenyl)sulfonylamino]-6-pyrrolidin-1-yl-hex-4-ynoic acid CAS Name: 2-[(4-phenylphenyl)sulfonylamino]-6-(1-pyrrolidinyl)-4-hexynoic acid IUPAC Name: 2-[(4-phenylphenyl)sulfonylamino]-6-pyrrolidin-1-ylhex-4-ynoic acid Traditional Name: 2-[(4-phenylphenyl)sulfonylamino]-6-pyrrolidino-hex-4-ynoic acid Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC#CCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CC#CCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4S/c25-22(26)21(10-4-5-15-24-16-6-7-17-24)23-29(27,28)20-13-11-19(12-14-20)18-8-2-1-3-9-18/h1-3,8-9,11-14,21,23H,6-7,10,15-17H2,(H,25,26)