[2-[(3-aminocarbonyl-4-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-(1,3-benzodioxol-5-ylmethyl)-methyl-azanium

Systemtic Name: [2-[(3-aminocarbonyl-4-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-(1,3-benzodioxol-5-ylmethyl)-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-[(3-carbamoyl-4-ethoxycarbonyl-5-methyl-2-furyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-[(3-carbamoyl-4-ethoxycarbonyl-5-methyl-2-furanyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-[(3-carbamoyl-4-ethoxycarbonyl-5-methylfuran-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[(3-carbamoyl-4-carbethoxy-5-methyl-2-furyl)amino]-2-keto-ethyl]-methyl-piperonyl-ammonium Formula: C20H24N3O7+ MolecularWeight: 418.42046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C20H23N3O7/c1-4-27-20(26)16-11(2)30-19(17(16)18(21)25)22-15(24)9-23(3)8-12-5-6-13-14(7-12)29-10-28-13/h5-7H,4,8-10H2,1-3H3,(H2,21,25)(H,22,24)/p+1