(2R,3S)-2-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]carbonylamino]-3-methyl-pentanoate

Systemtic Name: (2R,3S)-2-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]carbonylamino]-3-methyl-pentanoate Openeye Name: (2R,3S)-2-[[4-(4-dimethylaminophenyl)azobenzoyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[[4-(4-dimethylaminophenyl)azophenyl]-oxomethyl]amino]-3-methylpentanoate IUPAC Name: (2R,3S)-2-[[4-[(4-dimethylaminophenyl)diazenyl]benzoyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[4-(4-dimethylaminophenyl)azobenzoyl]amino]-3-methyl-valerate Formula: C21H25N4O3- MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)[O-])NC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C21H26N4O3/c1-5-14(2)19(21(27)28)22-20(26)15-6-8-16(9-7-15)23-24-17-10-12-18(13-11-17)25(3)4/h6-14,19H,5H2,1-4H3,(H,22,26)(H,27,28)/p-1/t14-,19+/m0/s1