3-[1-[4-[(4-aminocarbonylphenyl)methoxy]phenyl]sulfonyl-5-methoxy-indol-3-yl]propanoic acid

Systemtic Name: 3-[1-[4-[(4-aminocarbonylphenyl)methoxy]phenyl]sulfonyl-5-methoxy-indol-3-yl]propanoic acid Openeye Name: 3-[1-[4-[(4-carbamoylphenyl)methoxy]phenyl]sulfonyl-5-methoxy-indol-3-yl]propanoic acid CAS Name: 3-[1-[4-[(4-carbamoylphenyl)methoxy]phenyl]sulfonyl-5-methoxy-3-indolyl]propanoic acid IUPAC Name: 3-[1-[4-[(4-carbamoylphenyl)methoxy]phenyl]sulfonyl-5-methoxyindol-3-yl]propanoic acid Traditional Name: 3-[1-[4-(4-carbamoylbenzyl)oxyphenyl]sulfonyl-5-methoxy-indol-3-yl]propionic acid Formula: C26H24N2O7S MolecularWeight: 508.54296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=C(C=C4)C(=O)N

InChI

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