1-cyanoethyl 3-phenothiazin-10-ylpropanoate

Systemtic Name: 1-cyanoethyl 3-phenothiazin-10-ylpropanoate Openeye Name: 1-cyanoethyl 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid 1-cyanoethyl ester Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CCN1C2=CC=CC=C2SC3=CC=CC=C31

Isomeric SMILES

CC(C#N)OC(=O)CCN1C2=CC=CC=C2SC3=CC=CC=C31

InChI

InChI=1S/C18H16N2O2S/c1-13(12-19)22-18(21)10-11-20-14-6-2-4-8-16(14)23-17-9-5-3-7-15(17)20/h2-9,13H,10-11H2,1H3