4-[2-[2-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanoyl]hydrazinyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[2-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanoyl]hydrazinyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetyl]hydrazino]-4-oxo-butanoic acid CAS Name: 4-[[2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-1-oxoethyl]hydrazo]-4-oxobutanoic acid IUPAC Name: 4-[2-[2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetyl]hydrazinyl]-4-oxobutanoic acid Traditional Name: 4-[N'-[2-(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetyl]hydrazino]-4-keto-butyric acid Formula: C21H19ClN4O5 MolecularWeight: 442.85236

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)NNC(=O)CCC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)NNC(=O)CCC(=O)O

InChI

InChI=1S/C21H19ClN4O5/c22-14-6-7-16-15(10-14)21(13-4-2-1-3-5-13)23-11-19(29)26(16)12-18(28)25-24-17(27)8-9-20(30)31/h1-7,10H,8-9,11-12H2,(H,24,27)(H,25,28)(H,30,31)