N-[(7-methoxy-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-thiophen-3-yl-ethanamide

Systemtic Name: N-[(7-methoxy-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-thiophen-3-yl-ethanamide Openeye Name: N-[(7-methoxy-2-morpholino-quinolin-1-ium-3-yl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-(3-thienyl)acetamide CAS Name: N-[[7-methoxy-2-(4-morpholinyl)-3-quinolin-1-iumyl]methyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-(3-thiophenyl)acetamide IUPAC Name: N-[(7-methoxy-2-morpholin-4-ylquinolin-1-ium-3-yl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-thiophen-3-ylacetamide Traditional Name: N-[3-(2-ketopyrrolidino)propyl]-N-[(7-methoxy-2-morpholino-quinolin-1-ium-3-yl)methyl]-2-(3-thienyl)acetamide Formula: C28H35N4O4S+ MolecularWeight: 523.6669

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=[NH+]C(=C(C=C2C=C1)CN(CCCN3CCCC3=O)C(=O)CC4=CSC=C4)N5CCOCC5

Isomeric SMILES

COC1=CC2=[NH+]C(=C(C=C2C=C1)CN(CCCN3CCCC3=O)C(=O)CC4=CSC=C4)N5CCOCC5

InChI

InChI=1S/C28H34N4O4S/c1-35-24-6-5-22-17-23(28(29-25(22)18-24)31-11-13-36-14-12-31)19-32(27(34)16-21-7-15-37-20-21)10-3-9-30-8-2-4-26(30)33/h5-7,15,17-18,20H,2-4,8-14,16,19H2,1H3/p+1