[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: [2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: [2-(4-carbamoylanilino)-2-oxo-ethyl]-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: [2-(4-carbamoylanilino)-2-oxoethyl]-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylammonium IUPAC Name: [2-(4-carbamoylanilino)-2-oxoethyl]-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylazanium Traditional Name: [2-(4-carbamoylanilino)-2-keto-ethyl]-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-ethyl-ammonium Formula: C21H25N4O5+ MolecularWeight: 413.447

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=CC=C(C=C1)C(=O)N)CC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC[NH+](CC(=O)NC1=CC=C(C=C1)C(=O)N)CC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H24N4O5/c1-2-25(12-19(26)23-15-5-3-14(4-6-15)21(22)28)13-20(27)24-16-7-8-17-18(11-16)30-10-9-29-17/h3-8,11H,2,9-10,12-13H2,1H3,(H2,22,28)(H,23,26)(H,24,27)/p+1