3-(8-chloranyl-2-methoxy-3-oxidanyl-phenothiazin-10-yl)propanenitrile

Systemtic Name: 3-(8-chloranyl-2-methoxy-3-oxidanyl-phenothiazin-10-yl)propanenitrile Openeye Name: 3-(8-chloro-3-hydroxy-2-methoxy-phenothiazin-10-yl)propanenitrile CAS Name: 3-(8-chloro-3-hydroxy-2-methoxy-10-phenothiazinyl)propanenitrile IUPAC Name: 3-(8-chloro-3-hydroxy-2-methoxyphenothiazin-10-yl)propanenitrile Traditional Name: 3-(8-chloro-3-hydroxy-2-methoxy-phenothiazin-10-yl)propionitrile Formula: C16H13ClN2O2S MolecularWeight: 332.80462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)CCC#N)O

Isomeric SMILES

COC1=C(C=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)CCC#N)O

InChI

InChI=1S/C16H13ClN2O2S/c1-21-14-8-12-16(9-13(14)20)22-15-4-3-10(17)7-11(15)19(12)6-2-5-18/h3-4,7-9,20H,2,6H2,1H3