(2Z)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]propanoic acid

Systemtic Name: (2Z)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]propanoic acid Openeye Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]propanoic acid CAS Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]propanoic acid IUPAC Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]propanoic acid Traditional Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]propionic acid Formula: C18H15ClN4O2 MolecularWeight: 354.7903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C/C(=N/NC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C18H15ClN4O2/c1-11(18(24)25)22-23-16-10-20-17(12-5-3-2-4-6-12)14-9-13(19)7-8-15(14)21-16/h2-9H,10H2,1H3,(H,21,23)(H,24,25)/b22-11-