2-[[4-[4-(2-methoxyethoxy)phenyl]phenyl]sulfonylamino]-6-phenyl-hex-4-ynoic acid

Systemtic Name: 2-[[4-[4-(2-methoxyethoxy)phenyl]phenyl]sulfonylamino]-6-phenyl-hex-4-ynoic acid Openeye Name: 2-[[4-[4-(2-methoxyethoxy)phenyl]phenyl]sulfonylamino]-6-phenyl-hex-4-ynoic acid CAS Name: 2-[[4-[4-(2-methoxyethoxy)phenyl]phenyl]sulfonylamino]-6-phenyl-4-hexynoic acid IUPAC Name: 2-[[4-[4-(2-methoxyethoxy)phenyl]phenyl]sulfonylamino]-6-phenylhex-4-ynoic acid Traditional Name: 2-[[4-[4-(2-methoxyethoxy)phenyl]phenyl]sulfonylamino]-6-phenyl-hex-4-ynoic acid Formula: C27H27NO6S MolecularWeight: 493.57138

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COCCOC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H27NO6S/c1-33-19-20-34-24-15-11-22(12-16-24)23-13-17-25(18-14-23)35(31,32)28-26(27(29)30)10-6-5-9-21-7-3-2-4-8-21/h2-4,7-8,11-18,26,28H,9-10,19-20H2,1H3,(H,29,30)