2-[(2E)-2-(8-azanyl-3-methyl-1-oxidanylidene-6-sulfo-naphthalen-2-ylidene)hydrazinyl]naphthalene-1,5-disulfonic acid

Systemtic Name: 2-[(2E)-2-(8-azanyl-3-methyl-1-oxidanylidene-6-sulfo-naphthalen-2-ylidene)hydrazinyl]naphthalene-1,5-disulfonic acid Openeye Name: 2-[(2E)-2-(8-amino-3-methyl-1-oxo-6-sulfo-2-naphthylidene)hydrazino]naphthalene-1,5-disulfonic acid CAS Name: 2-[(2E)-2-(8-amino-3-methyl-1-oxo-6-sulfo-2-naphthalenylidene)hydrazinyl]naphthalene-1,5-disulfonic acid IUPAC Name: 2-[(2E)-2-(8-amino-3-methyl-1-oxo-6-sulfonaphthalen-2-ylidene)hydrazinyl]naphthalene-1,5-disulfonic acid Traditional Name: 2-[(N'E)-N'-(8-amino-1-keto-3-methyl-6-sulfo-2-naphthylidene)hydrazino]naphthalene-1,5-disulfonic acid Formula: C21H17N3O10S3 MolecularWeight: 567.56878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=CC(=C2C(=O)C1=NNC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)O)S(=O)(=O)O)N)S(=O)(=O)O

Isomeric SMILES

CC\1=CC2=CC(=CC(=C2C(=O)/C1=N/NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)O)S(=O)(=O)O)N)S(=O)(=O)O

InChI

InChI=1S/C21H17N3O10S3/c1-10-7-11-8-12(35(26,27)28)9-15(22)18(11)20(25)19(10)24-23-16-6-5-13-14(21(16)37(32,33)34)3-2-4-17(13)36(29,30)31/h2-9,23H,22H2,1H3,(H,26,27,28)(H,29,30,31)(H,32,33,34)/b24-19+