tert-butyl 3-(2-chloranylphenothiazin-10-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-(2-chloranylphenothiazin-10-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 3-(2-chlorophenothiazin-10-yl)piperidine-1-carboxylate CAS Name: 3-(2-chloro-10-phenothiazinyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-chlorophenothiazin-10-yl)piperidine-1-carboxylate Traditional Name: 3-(2-chlorophenothiazin-10-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C22H25ClN2O2S/c1-22(2,3)27-21(26)24-12-6-7-16(14-24)25-17-8-4-5-9-19(17)28-20-11-10-15(23)13-18(20)25/h4-5,8-11,13,16H,6-7,12,14H2,1-3H3