5-(10H-phenothiazin-10-ium-10-yl)pentanoate

Systemtic Name: 5-(10H-phenothiazin-10-ium-10-yl)pentanoate Openeye Name: 5-(10H-phenothiazin-10-ium-10-yl)pentanoate CAS Name: 5-(10H-phenothiazin-10-ium-10-yl)pentanoate IUPAC Name: 5-(10H-phenothiazin-10-ium-10-yl)pentanoate Traditional Name: 5-(10H-phenothiazin-10-ium-10-yl)valerate Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[NH+](C3=CC=CC=C3S2)CCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)[NH+](C3=CC=CC=C3S2)CCCCC(=O)[O-]

InChI

InChI=1S/C17H17NO2S/c19-17(20)11-5-6-12-18-13-7-1-3-9-15(13)21-16-10-4-2-8-14(16)18/h1-4,7-10H,5-6,11-12H2,(H,19,20)