methyl 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoate

Systemtic Name: methyl 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoate Openeye Name: methyl 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoate CAS Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenylpent-4-ynoate Traditional Name: 2-[(4-m-phenetylphenyl)sulfonylamino]-5-phenyl-pent-4-ynoic acid methyl ester Formula: C26H25NO5S MolecularWeight: 463.5454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C26H25NO5S/c1-3-32-23-13-8-12-22(19-23)21-15-17-24(18-16-21)33(29,30)27-25(26(28)31-2)14-7-11-20-9-5-4-6-10-20/h4-6,8-10,12-13,15-19,25,27H,3,14H2,1-2H3