(4-methoxycarbonyl-5-methyl-furan-2-yl)methyl-methyl-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-methoxycarbonyl-5-methyl-furan-2-yl)methyl-methyl-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-methoxycarbonyl-5-methyl-2-furyl)methyl-methyl-[2-(4-morpholinoanilino)-2-oxo-ethyl]ammonium CAS Name: (4-methoxycarbonyl-5-methyl-2-furanyl)methyl-methyl-[2-[4-(4-morpholinyl)anilino]-2-oxoethyl]ammonium IUPAC Name: (4-methoxycarbonyl-5-methylfuran-2-yl)methyl-methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]azanium Traditional Name: (4-carbomethoxy-5-methyl-2-furyl)methyl-[2-keto-2-(4-morpholinoanilino)ethyl]-methyl-ammonium Formula: C21H28N3O5+ MolecularWeight: 402.46412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C[NH+](C)CC(=O)NC2=CC=C(C=C2)N3CCOCC3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)C[NH+](C)CC(=O)NC2=CC=C(C=C2)N3CCOCC3)C(=O)OC

InChI

InChI=1S/C21H27N3O5/c1-15-19(21(26)27-3)12-18(29-15)13-23(2)14-20(25)22-16-4-6-17(7-5-16)24-8-10-28-11-9-24/h4-7,12H,8-11,13-14H2,1-3H3,(H,22,25)/p+1