ethyl N-[10-(3-morpholin-4-ium-4-ylpropanoyl)phenothiazin-2-yl]carbamate

Systemtic Name: ethyl N-[10-(3-morpholin-4-ium-4-ylpropanoyl)phenothiazin-2-yl]carbamate Openeye Name: ethyl N-[10-(3-morpholin-4-ium-4-ylpropanoyl)phenothiazin-2-yl]carbamate CAS Name: N-[10-[3-(4-morpholin-4-iumyl)-1-oxopropyl]-2-phenothiazinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[10-(3-morpholin-4-ium-4-ylpropanoyl)phenothiazin-2-yl]carbamate Traditional Name: N-[10-(3-morpholin-4-ium-4-ylpropanoyl)phenothiazin-2-yl]carbamic acid ethyl ester Formula: C22H26N3O4S+ MolecularWeight: 428.52454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)CC[NH+]4CCOCC4

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)CC[NH+]4CCOCC4

InChI

InChI=1S/C22H25N3O4S/c1-2-29-22(27)23-16-7-8-20-18(15-16)25(17-5-3-4-6-19(17)30-20)21(26)9-10-24-11-13-28-14-12-24/h3-8,15H,2,9-14H2,1H3,(H,23,27)/p+1