4-benzamidonaphthalene-1-sulfonate; pyridin-1-ium

Systemtic Name: 4-benzamidonaphthalene-1-sulfonate; pyridin-1-ium Openeye Name: 4-benzamidonaphthalene-1-sulfonate; pyridin-1-ium CAS Name: 4-benzamido-1-naphthalenesulfonate; pyridin-1-ium IUPAC Name: 4-benzamidonaphthalene-1-sulfonate; pyridin-1-ium Traditional Name: 4-benzamidonaphthalene-1-sulfonate; pyridin-1-ium Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)[O-].C1=CC=[NH+]C=C1

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)[O-].C1=CC=[NH+]C=C1

InChI

InChI=1S/C17H13NO4S.C5H5N/c19-17(12-6-2-1-3-7-12)18-15-10-11-16(23(20,21)22)14-9-5-4-8-13(14)15;1-2-4-6-5-3-1/h1-11H,(H,18,19)(H,20,21,22);1-5H