[1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]pyrrolidin-3-yl] undec-10-enoate

Systemtic Name: [1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]pyrrolidin-3-yl] undec-10-enoate Openeye Name: [1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]pyrrolidin-3-yl] undec-10-enoate CAS Name: 10-undecenoic acid [1-[3-[2-(trifluoromethyl)-10-phenothiazinyl]propyl]-3-pyrrolidinyl] ester IUPAC Name: [1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]pyrrolidin-3-yl] undec-10-enoate Traditional Name: undec-10-enoic acid [1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]pyrrolidin-3-yl] ester Formula: C31H39F3N2O2S MolecularWeight: 560.71377

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC(=O)OC1CCN(C1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

Isomeric SMILES

C=CCCCCCCCCC(=O)OC1CCN(C1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C31H39F3N2O2S/c1-2-3-4-5-6-7-8-9-15-30(37)38-25-18-21-35(23-25)19-12-20-36-26-13-10-11-14-28(26)39-29-17-16-24(22-27(29)36)31(32,33)34/h2,10-11,13-14,16-17,22,25H,1,3-9,12,15,18-21,23H2