10-[3-(4-oxidanylpiperidin-1-ium-1-yl)propyl]phenothiazine-2-carbonitrile

Systemtic Name: 10-[3-(4-oxidanylpiperidin-1-ium-1-yl)propyl]phenothiazine-2-carbonitrile Openeye Name: 10-[3-(4-hydroxypiperidin-1-ium-1-yl)propyl]phenothiazine-2-carbonitrile CAS Name: 10-[3-(4-hydroxy-1-piperidin-1-iumyl)propyl]-2-phenothiazinecarbonitrile IUPAC Name: 10-[3-(4-hydroxypiperidin-1-ium-1-yl)propyl]phenothiazine-2-carbonitrile Traditional Name: 10-[3-(4-hydroxypiperidin-1-ium-1-yl)propyl]phenothiazine-2-carbonitrile Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1O)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C#N

Isomeric SMILES

C1C[NH+](CCC1O)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C#N

InChI

InChI=1S/C21H23N3OS/c22-15-16-6-7-21-19(14-16)24(18-4-1-2-5-20(18)26-21)11-3-10-23-12-8-17(25)9-13-23/h1-2,4-7,14,17,25H,3,8-13H2/p+1