diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-phenoxyethanoyl)amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-phenoxyethanoyl)amino]ethyl]azanium Openeye Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-phenoxyacetyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(1-oxo-2-phenoxyethyl)amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-phenoxyacetyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-phenoxyacetyl)amino]ethyl]ammonium Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)COC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3S/c1-5-25(6-2)14-15-26(20(27)16-29-18-10-8-7-9-11-18)23-24-21-19(28-4)13-12-17(3)22(21)30-23/h7-13H,5-6,14-16H2,1-4H3/p+1