7-chloranyl-1-[2-(4-nitrophenoxy)ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-[2-(4-nitrophenoxy)ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-[2-(4-nitrophenoxy)ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-[2-(4-nitrophenoxy)ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-[2-(4-nitrophenoxy)ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-[2-(4-nitrophenoxy)ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C23H18ClN3O4 MolecularWeight: 435.85972

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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)CCOC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCOC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18ClN3O4/c24-17-6-11-21-20(14-17)23(16-4-2-1-3-5-16)25-15-22(28)26(21)12-13-31-19-9-7-18(8-10-19)27(29)30/h1-11,14H,12-13,15H2