ethyl 2-[4-[(Z)-3-(10-ethylphenothiazin-2-yl)but-2-enoxy]phenoxy]-2-methyl-butanoate

Systemtic Name: ethyl 2-[4-[(Z)-3-(10-ethylphenothiazin-2-yl)but-2-enoxy]phenoxy]-2-methyl-butanoate Openeye Name: ethyl 2-[4-[(Z)-3-(10-ethylphenothiazin-2-yl)but-2-enoxy]phenoxy]-2-methyl-butanoate CAS Name: 2-[4-[(Z)-3-(10-ethyl-2-phenothiazinyl)but-2-enoxy]phenoxy]-2-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[(Z)-3-(10-ethylphenothiazin-2-yl)but-2-enoxy]phenoxy]-2-methylbutanoate Traditional Name: 2-[4-[(Z)-3-(10-ethylphenothiazin-2-yl)but-2-enoxy]phenoxy]-2-methyl-butyric acid ethyl ester Formula: C31H35NO4S MolecularWeight: 517.6789

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OCC)OC1=CC=C(C=C1)OCC=C(C)C2=CC3=C(C=C2)SC4=CC=CC=C4N3CC

Isomeric SMILES

CCC(C)(C(=O)OCC)OC1=CC=C(C=C1)OC/C=C(/C)\C2=CC3=C(C=C2)SC4=CC=CC=C4N3CC

InChI

InChI=1S/C31H35NO4S/c1-6-31(5,30(33)34-8-3)36-25-16-14-24(15-17-25)35-20-19-22(4)23-13-18-29-27(21-23)32(7-2)26-11-9-10-12-28(26)37-29/h9-19,21H,6-8,20H2,1-5H3/b22-19-