methyl 2-[3-[4-[4-(dimethylaminodiazenyl)phenyl]carbonylphenoxy]propanoylamino]ethanoate

Systemtic Name: methyl 2-[3-[4-[4-(dimethylaminodiazenyl)phenyl]carbonylphenoxy]propanoylamino]ethanoate Openeye Name: methyl 2-[3-[4-[4-(dimethylaminoazo)benzoyl]phenoxy]propanoylamino]acetate CAS Name: 2-[[3-[4-[[4-(dimethylaminoazo)phenyl]-oxomethyl]phenoxy]-1-oxopropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[3-[4-[4-(dimethylaminodiazenyl)benzoyl]phenoxy]propanoylamino]acetate Traditional Name: 2-[3-[4-[4-(dimethylaminoazo)benzoyl]phenoxy]propanoylamino]acetic acid methyl ester Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)N=NC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCCC(=O)NCC(=O)OC

Isomeric SMILES

CN(C)N=NC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCCC(=O)NCC(=O)OC

InChI

InChI=1S/C21H24N4O5/c1-25(2)24-23-17-8-4-15(5-9-17)21(28)16-6-10-18(11-7-16)30-13-12-19(26)22-14-20(27)29-3/h4-11H,12-14H2,1-3H3,(H,22,26)