[9-[2-[[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]oxy-4-oxidanylidene-butyl]-methyl-carbamoyl]phenyl]-6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium

Systemtic Name: [9-[2-[[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]oxy-4-oxidanylidene-butyl]-methyl-carbamoyl]phenyl]-6-(diethylamino)xanthen-3-ylidene]-diethyl-azanium Openeye Name: [6-(diethylamino)-9-[2-[[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxo-butyl]-methyl-carbamoyl]phenyl]xanthen-3-ylidene]-diethyl-ammonium CAS Name: [6-(diethylamino)-9-[2-[[[4-[(2,5-dioxo-1-pyrrolidinyl)oxy]-4-oxobutyl]-methylamino]-oxomethyl]phenyl]-3-xanthenylidene]-diethylammonium IUPAC Name: [6-(diethylamino)-9-[2-[[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutyl]-methylcarbamoyl]phenyl]xanthen-3-ylidene]-diethylazanium Traditional Name: [6-(diethylamino)-9-[2-[(4-keto-4-succinimidooxy-butyl)-methyl-carbamoyl]phenyl]xanthen-3-ylidene]-diethyl-ammonium Formula: C37H43N4O6+ MolecularWeight: 639.76052

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)N(C)CCCC(=O)ON5C(=O)CCC5=O

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)N(C)CCCC(=O)ON5C(=O)CCC5=O

InChI

InChI=1S/C37H43N4O6/c1-6-39(7-2)25-16-18-29-31(23-25)46-32-24-26(40(8-3)9-4)17-19-30(32)36(29)27-13-10-11-14-28(27)37(45)38(5)22-12-15-35(44)47-41-33(42)20-21-34(41)43/h10-11,13-14,16-19,23-24H,6-9,12,15,20-22H2,1-5H3/q+1