ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium

Systemtic Name: ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium Openeye Name: (2-anilino-2-oxo-ethyl)-ethyl-[[3-methoxy-4-(2-thienylmethoxy)phenyl]methyl]ammonium CAS Name: (2-anilino-2-oxoethyl)-ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]ammonium IUPAC Name: (2-anilino-2-oxoethyl)-ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Traditional Name: (2-anilino-2-keto-ethyl)-ethyl-[3-methoxy-4-(2-thenyloxy)benzyl]ammonium Formula: C23H27N2O3S+ MolecularWeight: 411.53708

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OCC2=CC=CS2)OC)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OCC2=CC=CS2)OC)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O3S/c1-3-25(16-23(26)24-19-8-5-4-6-9-19)15-18-11-12-21(22(14-18)27-2)28-17-20-10-7-13-29-20/h4-14H,3,15-17H2,1-2H3,(H,24,26)/p+1