(E)-4-[[3-(1-methylindol-3-yl)-4-(1-methyl-6-nitro-indol-3-yl)-2,5-bis(oxidanylidene)pyrrol-1-yl]methoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3-(1-methylindol-3-yl)-4-(1-methyl-6-nitro-indol-3-yl)-2,5-bis(oxidanylidene)pyrrol-1-yl]methoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[3-(1-methylindol-3-yl)-4-(1-methyl-6-nitro-indol-3-yl)-2,5-dioxo-pyrrol-1-yl]methoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[3-(1-methyl-3-indolyl)-4-(1-methyl-6-nitro-3-indolyl)-2,5-dioxo-1-pyrrolyl]methoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[3-(1-methylindol-3-yl)-4-(1-methyl-6-nitroindol-3-yl)-2,5-dioxopyrrol-1-yl]methoxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[2,5-diketo-3-(1-methylindol-3-yl)-4-(1-methyl-6-nitro-indol-3-yl)-3-pyrrolin-1-yl]methoxy]-4-keto-but-2-enoic acid Formula: C27H20N4O8 MolecularWeight: 528.4697

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)COC(=O)C=CC(=O)O)C4=CN(C5=C4C=CC(=C5)[N+](=O)[O-])C

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)COC(=O)/C=C/C(=O)O)C4=CN(C5=C4C=CC(=C5)[N+](=O)[O-])C

InChI

InChI=1S/C27H20N4O8/c1-28-12-18(16-5-3-4-6-20(16)28)24-25(19-13-29(2)21-11-15(31(37)38)7-8-17(19)21)27(36)30(26(24)35)14-39-23(34)10-9-22(32)33/h3-13H,14H2,1-2H3,(H,32,33)/b10-9+