2-[[(3R,5R)-7-[[5-[(Z)-[4,5-bis(fluoranyl)-2-oxidanylidene-1H-indol-3-ylidene]methyl]-2,4-dimethyl-1H-pyrrol-3-yl]carbonylamino]-3,5-bis(oxidanyl)heptanoyl]amino]propanoic acid

Systemtic Name: 2-[[(3R,5R)-7-[[5-[(Z)-[4,5-bis(fluoranyl)-2-oxidanylidene-1H-indol-3-ylidene]methyl]-2,4-dimethyl-1H-pyrrol-3-yl]carbonylamino]-3,5-bis(oxidanyl)heptanoyl]amino]propanoic acid Openeye Name: 2-[[(3R,5R)-7-[[5-[(Z)-(4,5-difluoro-2-oxo-indolin-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carbonyl]amino]-3,5-dihydroxy-heptanoyl]amino]propanoic acid CAS Name: 2-[[(3R,5R)-7-[[[5-[(Z)-(4,5-difluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]-oxomethyl]amino]-3,5-dihydroxy-1-oxoheptyl]amino]propanoic acid IUPAC Name: 2-[[(3R,5R)-7-[[5-[(Z)-(4,5-difluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carbonyl]amino]-3,5-dihydroxyheptanoyl]amino]propanoic acid Traditional Name: 2-[[(3R,5R)-7-[[5-[(Z)-(4,5-difluoro-2-keto-indolin-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carbonyl]amino]-3,5-dihydroxy-heptanoyl]amino]propionic acid Formula: C26H30F2N4O7 MolecularWeight: 548.535806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)NCCC(CC(CC(=O)NC(C)C(=O)O)O)O)C)C=C2C3=C(C=CC(=C3F)F)NC2=O

Isomeric SMILES

CC1=C(NC(=C1C(=O)NCC[C@H](C[C@H](CC(=O)NC(C)C(=O)O)O)O)C)/C=C\2/C3=C(C=CC(=C3F)F)NC2=O

InChI

InChI=1S/C26H30F2N4O7/c1-11-19(10-16-22-18(32-24(16)36)5-4-17(27)23(22)28)30-12(2)21(11)25(37)29-7-6-14(33)8-15(34)9-20(35)31-13(3)26(38)39/h4-5,10,13-15,30,33-34H,6-9H2,1-3H3,(H,29,37)(H,31,35)(H,32,36)(H,38,39)/b16-10-/t13?,14-,15-/m1/s1