N-(2-azanyl-4-methoxy-phenyl)-3-thiomorpholin-4-ium-4-yl-propanamide

Systemtic Name: N-(2-azanyl-4-methoxy-phenyl)-3-thiomorpholin-4-ium-4-yl-propanamide Openeye Name: N-(2-amino-4-methoxy-phenyl)-3-thiomorpholin-4-ium-4-yl-propanamide CAS Name: N-(2-amino-4-methoxyphenyl)-3-(4-thiomorpholin-4-iumyl)propanamide IUPAC Name: N-(2-amino-4-methoxyphenyl)-3-thiomorpholin-4-ium-4-ylpropanamide Traditional Name: N-(2-amino-4-methoxy-phenyl)-3-thiomorpholin-4-ium-4-yl-propionamide Formula: C14H22N3O2S+ MolecularWeight: 296.40838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CC[NH+]2CCSCC2)N

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CC[NH+]2CCSCC2)N

InChI

InChI=1S/C14H21N3O2S/c1-19-11-2-3-13(12(15)10-11)16-14(18)4-5-17-6-8-20-9-7-17/h2-3,10H,4-9,15H2,1H3,(H,16,18)/p+1