10-methyl-3-[2-(4-nitrophenyl)ethynyl]phenothiazine

Systemtic Name: 10-methyl-3-[2-(4-nitrophenyl)ethynyl]phenothiazine Openeye Name: 10-methyl-3-[2-(4-nitrophenyl)ethynyl]phenothiazine CAS Name: 10-methyl-3-[2-(4-nitrophenyl)ethynyl]phenothiazine IUPAC Name: 10-methyl-3-[2-(4-nitrophenyl)ethynyl]phenothiazine Traditional Name: 10-methyl-3-[2-(4-nitrophenyl)ethynyl]phenothiazine Formula: C21H14N2O2S MolecularWeight: 358.41306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C#CC3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=CC=C41

Isomeric SMILES

CN1C2=C(C=C(C=C2)C#CC3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=CC=C41

InChI

InChI=1S/C21H14N2O2S/c1-22-18-4-2-3-5-20(18)26-21-14-16(10-13-19(21)22)7-6-15-8-11-17(12-9-15)23(24)25/h2-5,8-14H,1H3