(2Z)-2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-piperidin-1-yl-pentanoic acid

Systemtic Name: (2Z)-2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-piperidin-1-yl-pentanoic acid Openeye Name: (2Z)-2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]-5-(1-piperidyl)pentanoic acid CAS Name: (2Z)-2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-(1-piperidinyl)pentanoic acid IUPAC Name: (2Z)-2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-piperidin-1-ylpentanoic acid Traditional Name: (2Z)-2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]-5-piperidino-valeric acid Formula: C25H28N6O4 MolecularWeight: 476.52762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCC(=NNC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)CCC/C(=N/NC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2)C4=CC=CC=C4)/C(=O)O

InChI

InChI=1S/C25H28N6O4/c32-25(33)22(10-7-15-30-13-5-2-6-14-30)28-29-23-17-26-24(18-8-3-1-4-9-18)20-16-19(31(34)35)11-12-21(20)27-23/h1,3-4,8-9,11-12,16H,2,5-7,10,13-15,17H2,(H,27,29)(H,32,33)/b28-22-