[2-[(3-cyano-4,5-dimethyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [2-[(3-cyano-4,5-dimethyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [2-[(3-cyano-4,5-dimethyl-2-furyl)amino]-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [2-[(3-cyano-4,5-dimethyl-2-furanyl)amino]-2-oxoethyl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [2-[(3-cyano-4,5-dimethylfuran-2-yl)amino]-2-oxoethyl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [2-[(3-cyano-4,5-dimethyl-2-furyl)amino]-2-keto-ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C#N)NC(=O)C[NH+](C)CCOC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(OC(=C1C#N)NC(=O)C[NH+](C)CCOC2=CC=CC=C2)C

InChI

InChI=1S/C18H21N3O3/c1-13-14(2)24-18(16(13)11-19)20-17(22)12-21(3)9-10-23-15-7-5-4-6-8-15/h4-8H,9-10,12H2,1-3H3,(H,20,22)/p+1