ethanedioic acid; 1-(furan-2-ylmethylamino)-3-phenothiazin-10-yl-propan-2-ol

Systemtic Name: ethanedioic acid; 1-(furan-2-ylmethylamino)-3-phenothiazin-10-yl-propan-2-ol Openeye Name: 1-(2-furylmethylamino)-3-phenothiazin-10-yl-propan-2-ol; oxalic acid CAS Name: 1-(2-furanylmethylamino)-3-(10-phenothiazinyl)-2-propanol; oxalic acid IUPAC Name: 1-(furan-2-ylmethylamino)-3-phenothiazin-10-ylpropan-2-ol; oxalic acid Traditional Name: 1-(2-furfurylamino)-3-phenothiazin-10-yl-propan-2-ol; oxalic acid Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CC(CNCC4=CC=CO4)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CC(CNCC4=CC=CO4)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H20N2O2S.C2H2O4/c23-15(12-21-13-16-6-5-11-24-16)14-22-17-7-1-3-9-19(17)25-20-10-4-2-8-18(20)22;3-1(4)2(5)6/h1-11,15,21,23H,12-14H2;(H,3,4)(H,5,6)