N-(diphenylmethyl)-6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]hexanamide

Systemtic Name: N-(diphenylmethyl)-6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]hexanamide Openeye Name: N-benzhydryl-6-(4-nitro-1,3-dioxo-isoindolin-2-yl)hexanamide CAS Name: N-(diphenylmethyl)-6-(4-nitro-1,3-dioxo-2-isoindolyl)hexanamide IUPAC Name: N-benzhydryl-6-(4-nitro-1,3-dioxoisoindol-2-yl)hexanamide Traditional Name: N-benzhydryl-6-(1,3-diketo-4-nitro-isoindolin-2-yl)hexanamide Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CCCCCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CCCCCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H25N3O5/c31-23(28-25(19-11-4-1-5-12-19)20-13-6-2-7-14-20)17-8-3-9-18-29-26(32)21-15-10-16-22(30(34)35)24(21)27(29)33/h1-2,4-7,10-16,25H,3,8-9,17-18H2,(H,28,31)