1,3-benzodioxol-5-ylmethyl-[2-[[4-[(4-ethoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[[4-[(4-ethoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-[4-[(4-ethoxyphenyl)carbamoyl]anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-[4-[(4-ethoxyanilino)-oxomethyl]anilino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-[4-[(4-ethoxyphenyl)carbamoyl]anilino]-2-oxoethyl]-methylazanium Traditional Name: [2-keto-2-[4-(p-phenetylcarbamoyl)anilino]ethyl]-methyl-piperonyl-ammonium Formula: C26H28N3O5+ MolecularWeight: 462.51762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C[NH+](C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C[NH+](C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H27N3O5/c1-3-32-22-11-9-21(10-12-22)28-26(31)19-5-7-20(8-6-19)27-25(30)16-29(2)15-18-4-13-23-24(14-18)34-17-33-23/h4-14H,3,15-17H2,1-2H3,(H,27,30)(H,28,31)/p+1