2-azanyl-2-[2-[(4-methoxyphenyl)carbonylamino]phenyl]sulfonyl-6-phenoxy-hex-4-ynoic acid

Systemtic Name: 2-azanyl-2-[2-[(4-methoxyphenyl)carbonylamino]phenyl]sulfonyl-6-phenoxy-hex-4-ynoic acid Openeye Name: 2-amino-2-[2-[(4-methoxybenzoyl)amino]phenyl]sulfonyl-6-phenoxy-hex-4-ynoic acid CAS Name: 2-amino-2-[2-[[(4-methoxyphenyl)-oxomethyl]amino]phenyl]sulfonyl-6-phenoxy-4-hexynoic acid IUPAC Name: 2-amino-2-[2-[(4-methoxybenzoyl)amino]phenyl]sulfonyl-6-phenoxyhex-4-ynoic acid Traditional Name: 2-amino-2-[2-(p-anisoylamino)phenyl]sulfonyl-6-phenoxy-hex-4-ynoic acid Formula: C26H24N2O7S MolecularWeight: 508.54296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S(=O)(=O)C(CC#CCOC3=CC=CC=C3)(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S(=O)(=O)C(CC#CCOC3=CC=CC=C3)(C(=O)O)N

InChI

InChI=1S/C26H24N2O7S/c1-34-20-15-13-19(14-16-20)24(29)28-22-11-5-6-12-23(22)36(32,33)26(27,25(30)31)17-7-8-18-35-21-9-3-2-4-10-21/h2-6,9-16H,17-18,27H2,1H3,(H,28,29)(H,30,31)