2-methyl-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoic acid

Systemtic Name: 2-methyl-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoic acid Openeye Name: 2-methyl-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoic acid CAS Name: 2-methyl-3-[4-[2-(10-phenothiazinyl)ethoxy]phenyl]propanoic acid IUPAC Name: 2-methyl-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoic acid Traditional Name: 2-methyl-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propionic acid Formula: C24H23NO3S MolecularWeight: 405.50932

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)OCCN2C3=CC=CC=C3SC4=CC=CC=C42)C(=O)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)OCCN2C3=CC=CC=C3SC4=CC=CC=C42)C(=O)O

InChI

InChI=1S/C24H23NO3S/c1-17(24(26)27)16-18-10-12-19(13-11-18)28-15-14-25-20-6-2-4-8-22(20)29-23-9-5-3-7-21(23)25/h2-13,17H,14-16H2,1H3,(H,26,27)