2-[3-[(Z)-(1-ethyl-5-morpholin-4-ylsulfonyl-2-oxidanylidene-indol-3-ylidene)methyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(Z)-(1-ethyl-5-morpholin-4-ylsulfonyl-2-oxidanylidene-indol-3-ylidene)methyl]indol-1-yl]ethanoic acid Openeye Name: 2-[3-[(Z)-(1-ethyl-5-morpholinosulfonyl-2-oxo-indolin-3-ylidene)methyl]indol-1-yl]acetic acid CAS Name: 2-[3-[(Z)-[1-ethyl-5-(4-morpholinylsulfonyl)-2-oxo-3-indolylidene]methyl]-1-indolyl]acetic acid IUPAC Name: 2-[3-[(Z)-(1-ethyl-5-morpholin-4-ylsulfonyl-2-oxoindol-3-ylidene)methyl]indol-1-yl]acetic acid Traditional Name: 2-[3-[(Z)-(1-ethyl-2-keto-5-morpholinosulfonyl-indolin-3-ylidene)methyl]indol-1-yl]acetic acid Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=CN(C5=CC=CC=C54)CC(=O)O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)/C(=C/C4=CN(C5=CC=CC=C54)CC(=O)O)/C1=O

InChI

InChI=1S/C25H25N3O6S/c1-2-28-23-8-7-18(35(32,33)27-9-11-34-12-10-27)14-20(23)21(25(28)31)13-17-15-26(16-24(29)30)22-6-4-3-5-19(17)22/h3-8,13-15H,2,9-12,16H2,1H3,(H,29,30)/b21-13-