6-(2-azanylethylamino)-4-methyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5,8-disulfonic acid

Systemtic Name: 6-(2-azanylethylamino)-4-methyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5,8-disulfonic acid Openeye Name: 6-(2-aminoethylamino)-4-methyl-1,3-dioxo-benzo[de]isoquinoline-5,8-disulfonic acid CAS Name: 6-(2-aminoethylamino)-4-methyl-1,3-dioxobenzo[de]isoquinoline-5,8-disulfonic acid IUPAC Name: 6-(2-aminoethylamino)-4-methyl-1,3-dioxobenzo[de]isoquinoline-5,8-disulfonic acid Traditional Name: 6-(2-aminoethylamino)-1,3-diketo-4-methyl-benzo[de]isoquinoline-5,8-disulfonic acid Formula: C15H15N3O8S2 MolecularWeight: 429.4249

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3=C(C=C(C=C3C(=C1S(=O)(=O)O)NCCN)S(=O)(=O)O)C(=O)NC2=O

Isomeric SMILES

CC1=C2C3=C(C=C(C=C3C(=C1S(=O)(=O)O)NCCN)S(=O)(=O)O)C(=O)NC2=O

InChI

InChI=1S/C15H15N3O8S2/c1-6-10-11-8(12(17-3-2-16)13(6)28(24,25)26)4-7(27(21,22)23)5-9(11)14(19)18-15(10)20/h4-5,17H,2-3,16H2,1H3,(H,18,19,20)(H,21,22,23)(H,24,25,26)