2-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylazaniumyl]ethyl-diethyl-azanium

Systemtic Name: 2-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylazaniumyl]ethyl-diethyl-azanium Openeye Name: 2-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methylammonio]ethyl-diethyl-ammonium CAS Name: 2-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylammonio]ethyl-diethylammonium IUPAC Name: 2-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylazaniumyl]ethyl-diethylazanium Traditional Name: 2-[[3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]ammonio]ethyl-diethyl-ammonium Formula: C19H29ClN2O2S+2 MolecularWeight: 384.96376

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC

Isomeric SMILES

CC[NH+](CC)CC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC

InChI

InChI=1S/C19H27ClN2O2S/c1-4-22(5-2)9-8-21-13-15-11-17(20)19(18(12-15)23-3)24-14-16-7-6-10-25-16/h6-7,10-12,21H,4-5,8-9,13-14H2,1-3H3/p+2