2-azanyl-5-benzamido-3-methyl-naphthalene-1-sulfonic acid

Systemtic Name: 2-azanyl-5-benzamido-3-methyl-naphthalene-1-sulfonic acid Openeye Name: 2-amino-5-benzamido-3-methyl-naphthalene-1-sulfonic acid CAS Name: 2-amino-5-benzamido-3-methyl-1-naphthalenesulfonic acid IUPAC Name: 2-amino-5-benzamido-3-methylnaphthalene-1-sulfonic acid Traditional Name: 2-amino-5-benzamido-3-methyl-naphthalene-1-sulfonic acid Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC=C(C2=C1)NC(=O)C3=CC=CC=C3)S(=O)(=O)O)N

Isomeric SMILES

CC1=C(C(=C2C=CC=C(C2=C1)NC(=O)C3=CC=CC=C3)S(=O)(=O)O)N

InChI

InChI=1S/C18H16N2O4S/c1-11-10-14-13(17(16(11)19)25(22,23)24)8-5-9-15(14)20-18(21)12-6-3-2-4-7-12/h2-10H,19H2,1H3,(H,20,21)(H,22,23,24)