[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methyl-(2-thienylmethyl)ammonium CAS Name: [4-methoxy-3-(4-morpholin-4-iumylmethyl)phenyl]methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [4-methoxy-3-(morpholin-4-ium-4-ylmethyl)benzyl]-(2-thenyl)ammonium Formula: C18H26N2O2S+2 MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CC2=CC=CS2)C[NH+]3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CC2=CC=CS2)C[NH+]3CCOCC3

InChI

InChI=1S/C18H24N2O2S/c1-21-18-5-4-15(12-19-13-17-3-2-10-23-17)11-16(18)14-20-6-8-22-9-7-20/h2-5,10-11,19H,6-9,12-14H2,1H3/p+2