[2-[(3-aminocarbonyl-4-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-tert-butylphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(3-aminocarbonyl-4-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-tert-butylphenyl)methyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-[(3-carbamoyl-4-ethoxycarbonyl-5-methyl-2-furyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-[(3-carbamoyl-4-ethoxycarbonyl-5-methyl-2-furanyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-[(3-carbamoyl-4-ethoxycarbonyl-5-methylfuran-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-[(3-carbamoyl-4-carbethoxy-5-methyl-2-furyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C23H32N3O5+ MolecularWeight: 430.51728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C23H31N3O5/c1-7-30-22(29)18-14(2)31-21(19(18)20(24)28)25-17(27)13-26(6)12-15-8-10-16(11-9-15)23(3,4)5/h8-11H,7,12-13H2,1-6H3,(H2,24,28)(H,25,27)/p+1