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8-(quinolin-4-ylamino)naphthalene-1,3,5-trisulfonic acid

8-(quinolin-4-ylamino)naphthalene-1,3,5-trisulfonic acid

Systemtic Name:8-(quinolin-4-ylamino)naphthalene-1,3,5-trisulfonic acid
Openeye Name:8-(4-quinolylamino)naphthalene-1,3,5-trisulfonic acid
CAS Name:8-(4-quinolinylamino)naphthalene-1,3,5-trisulfonic acid
IUPAC Name:8-(quinolin-4-ylamino)naphthalene-1,3,5-trisulfonic acid
Traditional Name:8-(4-quinolylamino)naphthalene-1,3,5-trisulfonic acid
Formula: C19H14N2O9S3
MolecularWeight: 510.51746
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)NC3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)NC3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O


InChI

InChI=1S/C19H14N2O9S3/c22-31(23,24)11-9-13-17(32(25,26)27)6-5-16(19(13)18(10-11)33(28,29)30)21-15-7-8-20-14-4-2-1-3-12(14)15/h1-10H,(H,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)


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