2-chloranyl-10-[3-(4-methoxy-4-phenyl-piperidin-1-yl)propyl]phenothiazine hydrochloride

Systemtic Name: 2-chloranyl-10-[3-(4-methoxy-4-phenyl-piperidin-1-yl)propyl]phenothiazine hydrochloride Openeye Name: 2-chloro-10-[3-(4-methoxy-4-phenyl-1-piperidyl)propyl]phenothiazine hydrochloride CAS Name: 2-chloro-10-[3-(4-methoxy-4-phenyl-1-piperidinyl)propyl]phenothiazine hydrochloride IUPAC Name: 2-chloro-10-[3-(4-methoxy-4-phenylpiperidin-1-yl)propyl]phenothiazine hydrochloride Traditional Name: 2-chloro-10-[3-(4-methoxy-4-phenyl-piperidino)propyl]phenothiazine hydrochloride Formula: C27H30Cl2N2OS MolecularWeight: 501.5109

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C5=CC=CC=C5.Cl

Isomeric SMILES

COC1(CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C5=CC=CC=C5.Cl

InChI

InChI=1S/C27H29ClN2OS.ClH/c1-31-27(21-8-3-2-4-9-21)14-18-29(19-15-27)16-7-17-30-23-10-5-6-11-25(23)32-26-13-12-22(28)20-24(26)30;/h2-6,8-13,20H,7,14-19H2,1H3;1H