tert-butyl 4-[3-[(4-cyanonaphthalen-1-yl)methyl]-4-nitro-2-propan-2-yl-benzimidazol-5-yl]oxypiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[(4-cyanonaphthalen-1-yl)methyl]-4-nitro-2-propan-2-yl-benzimidazol-5-yl]oxypiperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-[(4-cyano-1-naphthyl)methyl]-2-isopropyl-4-nitro-benzimidazol-5-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[3-[(4-cyano-1-naphthalenyl)methyl]-4-nitro-2-propan-2-yl-5-benzimidazolyl]oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[(4-cyanonaphthalen-1-yl)methyl]-4-nitro-2-propan-2-ylbenzimidazol-5-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[3-[(4-cyano-1-naphthyl)methyl]-2-isopropyl-4-nitro-benzimidazol-5-yl]oxypiperidine-1-carboxylic acid tert-butyl ester Formula: C32H35N5O5 MolecularWeight: 569.6508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1CC3=CC=C(C4=CC=CC=C34)C#N)C(=C(C=C2)OC5CCN(CC5)C(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=C(N1CC3=CC=C(C4=CC=CC=C34)C#N)C(=C(C=C2)OC5CCN(CC5)C(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C32H35N5O5/c1-20(2)30-34-26-12-13-27(41-23-14-16-35(17-15-23)31(38)42-32(3,4)5)29(37(39)40)28(26)36(30)19-22-11-10-21(18-33)24-8-6-7-9-25(22)24/h6-13,20,23H,14-17,19H2,1-5H3