sodium 2-ethoxy-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoate

Systemtic Name: sodium 2-ethoxy-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoate Openeye Name: sodium 2-ethoxy-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoate CAS Name: sodium 2-ethoxy-3-[4-[2-(10-phenothiazinyl)ethoxy]phenyl]propanoate IUPAC Name: sodium 2-ethoxy-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propanoate Traditional Name: sodium 2-ethoxy-3-[4-(2-phenothiazin-10-ylethoxy)phenyl]propionate Formula: C25H24NNaO4S MolecularWeight: 457.51713

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN2C3=CC=CC=C3SC4=CC=CC=C42)C(=O)[O-].[Na+]

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN2C3=CC=CC=C3SC4=CC=CC=C42)C(=O)[O-].[Na+]

InChI

InChI=1S/C25H25NO4S.Na/c1-2-29-22(25(27)28)17-18-11-13-19(14-12-18)30-16-15-26-20-7-3-5-9-23(20)31-24-10-6-4-8-21(24)26;/h3-14,22H,2,15-17H2,1H3,(H,27,28);/q;+1/p-1