tert-butyl N-[2-methyl-1-[[1-(6-nitro-1H-benzimidazol-2-yl)-2-phenylmethoxy-ethyl]amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[2-methyl-1-[[1-(6-nitro-1H-benzimidazol-2-yl)-2-phenylmethoxy-ethyl]amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[[2-benzyloxy-1-(6-nitro-1H-benzimidazol-2-yl)ethyl]amino]-1,1-dimethyl-2-oxo-ethyl]carbamate CAS Name: N-[2-methyl-1-[[1-(6-nitro-1H-benzimidazol-2-yl)-2-phenylmethoxyethyl]amino]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-methyl-1-[[1-(6-nitro-1H-benzimidazol-2-yl)-2-phenylmethoxyethyl]amino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[[2-benzoxy-1-(6-nitro-1H-benzimidazol-2-yl)ethyl]amino]-2-keto-1,1-dimethyl-ethyl]carbamic acid tert-butyl ester Formula: C25H31N5O6 MolecularWeight: 497.54354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(C)C(=O)NC(COCC1=CC=CC=C1)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(C)C(=O)NC(COCC1=CC=CC=C1)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H31N5O6/c1-24(2,3)36-23(32)29-25(4,5)22(31)28-20(15-35-14-16-9-7-6-8-10-16)21-26-18-12-11-17(30(33)34)13-19(18)27-21/h6-13,20H,14-15H2,1-5H3,(H,26,27)(H,28,31)(H,29,32)