5-azanyl-4-(6-methyl-1H-benzimidazol-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-(6-methyl-1H-benzimidazol-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-3-one Openeye Name: 5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-3-one CAS Name: 5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-1-[2-(4-morpholin-4-iumyl)ethyl]-2H-pyrrol-3-one IUPAC Name: 5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-3-one Traditional Name: 5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-2-pyrrolin-3-one Formula: C18H24N5O2+ MolecularWeight: 342.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C3=C(N(CC3=O)CC[NH+]4CCOCC4)N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C3=C(N(CC3=O)CC[NH+]4CCOCC4)N

InChI

InChI=1S/C18H23N5O2/c1-12-2-3-13-14(10-12)21-18(20-13)16-15(24)11-23(17(16)19)5-4-22-6-8-25-9-7-22/h2-3,10H,4-9,11,19H2,1H3,(H,20,21)/p+1