ethyl (2S)-2-[[4-(dimethylaminodiazenyl)phenyl]carbonylamino]-3-methyl-butanoate

Systemtic Name: ethyl (2S)-2-[[4-(dimethylaminodiazenyl)phenyl]carbonylamino]-3-methyl-butanoate Openeye Name: ethyl (2S)-2-[[4-(dimethylaminoazo)benzoyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[[4-(dimethylaminoazo)phenyl]-oxomethyl]amino]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[4-(dimethylaminodiazenyl)benzoyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[4-(dimethylaminoazo)benzoyl]amino]-3-methyl-butyric acid ethyl ester Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)NC(=O)C1=CC=C(C=C1)N=NN(C)C

Isomeric SMILES

CCOC(=O)[C@H](C(C)C)NC(=O)C1=CC=C(C=C1)N=NN(C)C

InChI

InChI=1S/C16H24N4O3/c1-6-23-16(22)14(11(2)3)17-15(21)12-7-9-13(10-8-12)18-19-20(4)5/h7-11,14H,6H2,1-5H3,(H,17,21)/t14-/m0/s1