methyl 3-[7-(3-methoxy-3-oxidanylidene-propyl)-10-methyl-phenothiazin-2-yl]propanoate

Systemtic Name: methyl 3-[7-(3-methoxy-3-oxidanylidene-propyl)-10-methyl-phenothiazin-2-yl]propanoate Openeye Name: methyl 3-[7-(3-methoxy-3-oxo-propyl)-10-methyl-phenothiazin-2-yl]propanoate CAS Name: 3-[7-(3-methoxy-3-oxopropyl)-10-methyl-2-phenothiazinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[7-(3-methoxy-3-oxopropyl)-10-methylphenothiazin-2-yl]propanoate Traditional Name: 3-[7-(3-keto-3-methoxy-propyl)-10-methyl-phenothiazin-2-yl]propionic acid methyl ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CCC(=O)OC)SC3=C1C=C(C=C3)CCC(=O)OC

Isomeric SMILES

CN1C2=C(C=C(C=C2)CCC(=O)OC)SC3=C1C=C(C=C3)CCC(=O)OC

InChI

InChI=1S/C21H23NO4S/c1-22-16-8-4-15(7-11-21(24)26-3)13-19(16)27-18-9-5-14(12-17(18)22)6-10-20(23)25-2/h4-5,8-9,12-13H,6-7,10-11H2,1-3H3