10-methyl-6-propoxy-phenothiazine-2-sulfonic acid

Systemtic Name: 10-methyl-6-propoxy-phenothiazine-2-sulfonic acid Openeye Name: 10-methyl-6-propoxy-phenothiazine-2-sulfonic acid CAS Name: 10-methyl-6-propoxy-2-phenothiazinesulfonic acid IUPAC Name: 10-methyl-6-propoxyphenothiazine-2-sulfonic acid Traditional Name: 10-methyl-6-propoxy-phenothiazine-2-sulfonic acid Formula: C16H17NO4S2 MolecularWeight: 351.44048

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC2=C1SC3=C(N2C)C=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CCCOC1=CC=CC2=C1SC3=C(N2C)C=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C16H17NO4S2/c1-3-9-21-14-6-4-5-12-16(14)22-15-8-7-11(23(18,19)20)10-13(15)17(12)2/h4-8,10H,3,9H2,1-2H3,(H,18,19,20)