[[N'-[5-methoxy-4-[[1-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]-5-oxidanylidene-pentyl]carbamimidoyl]amino]-oxidanyl-oxidanylidene-azanium

Systemtic Name: [[N'-[5-methoxy-4-[[1-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]-5-oxidanylidene-pentyl]carbamimidoyl]amino]-oxidanyl-oxidanylidene-azanium Openeye Name: hydroxy-[[N'-[4-[(1-hydroxy-9,10-dioxo-anthracene-2-carbonyl)amino]-5-methoxy-5-oxo-pentyl]carbamimidoyl]amino]-oxo-ammonium CAS Name: [[amino-[4-[[(1-hydroxy-9,10-dioxo-2-anthracenyl)-oxomethyl]amino]-5-methoxy-5-oxopentyl]iminomethyl]amino]-hydroxy-oxoammonium IUPAC Name: hydroxy-[[N'-[4-[(1-hydroxy-9,10-dioxoanthracene-2-carbonyl)amino]-5-methoxy-5-oxopentyl]carbamimidoyl]amino]-oxoazanium Traditional Name: hydroxy-[[N'-[4-[(1-hydroxy-9,10-diketo-anthracene-2-carbonyl)amino]-5-keto-5-methoxy-pentyl]amidino]amino]-keto-ammonium Formula: C22H22N5O8+ MolecularWeight: 484.43878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCN=C(N)N[N+](=O)O)NC(=O)C1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

COC(=O)C(CCCN=C(N)N[N+](=O)O)NC(=O)C1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C22H21N5O8/c1-35-21(32)15(7-4-10-24-22(23)26-27(33)34)25-20(31)14-9-8-13-16(19(14)30)18(29)12-6-3-2-5-11(12)17(13)28/h2-3,5-6,8-9,15H,4,7,10H2,1H3,(H5-,23,24,25,26,29,30,31,33,34)/p+1