[4-(4-cyanophenyl)phenyl] 3-phenothiazin-10-ylpropanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 3-phenothiazin-10-ylpropanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid [4-(4-cyanophenyl)phenyl] ester Formula: C28H20N2O2S MolecularWeight: 448.5356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C28H20N2O2S/c29-19-20-9-11-21(12-10-20)22-13-15-23(16-14-22)32-28(31)17-18-30-24-5-1-3-7-26(24)33-27-8-4-2-6-25(27)30/h1-16H,17-18H2