diethyl-[3-[2-(methoxycarbonylamino)phenothiazin-10-yl]-3-oxidanylidene-propyl]azanium

Systemtic Name: diethyl-[3-[2-(methoxycarbonylamino)phenothiazin-10-yl]-3-oxidanylidene-propyl]azanium Openeye Name: diethyl-[3-[2-(methoxycarbonylamino)phenothiazin-10-yl]-3-oxo-propyl]ammonium CAS Name: diethyl-[3-[2-(methoxycarbonylamino)-10-phenothiazinyl]-3-oxopropyl]ammonium IUPAC Name: diethyl-[3-[2-(methoxycarbonylamino)phenothiazin-10-yl]-3-oxopropyl]azanium Traditional Name: [3-[2-(carbomethoxyamino)phenothiazin-10-yl]-3-keto-propyl]-diethyl-ammonium Formula: C21H26N3O3S+ MolecularWeight: 400.51444

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)NC(=O)OC

Isomeric SMILES

CC[NH+](CC)CCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)NC(=O)OC

InChI

InChI=1S/C21H25N3O3S/c1-4-23(5-2)13-12-20(25)24-16-8-6-7-9-18(16)28-19-11-10-15(14-17(19)24)22-21(26)27-3/h6-11,14H,4-5,12-13H2,1-3H3,(H,22,26)/p+1