2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[[(2,4-dimethylanilino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl]-methylazanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-keto-ethyl]-methyl-ammonium Formula: C21H26N3O4+ MolecularWeight: 384.44884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C21H25N3O4/c1-14-4-6-17(15(2)10-14)22-21(26)23-20(25)13-24(3)12-16-5-7-18-19(11-16)28-9-8-27-18/h4-7,10-11H,8-9,12-13H2,1-3H3,(H2,22,23,25,26)/p+1