tert-butyl N-(2-nitro-3-phenylmethoxy-phenyl)-N-(3-oxidanylpropyl)carbamate

Systemtic Name: tert-butyl N-(2-nitro-3-phenylmethoxy-phenyl)-N-(3-oxidanylpropyl)carbamate Openeye Name: tert-butyl N-(3-benzyloxy-2-nitro-phenyl)-N-(3-hydroxypropyl)carbamate CAS Name: N-(3-hydroxypropyl)-N-(2-nitro-3-phenylmethoxyphenyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-hydroxypropyl)-N-(2-nitro-3-phenylmethoxyphenyl)carbamate Traditional Name: N-(3-benzoxy-2-nitro-phenyl)-N-(3-hydroxypropyl)carbamic acid tert-butyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCO)C1=C(C(=CC=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCO)C1=C(C(=CC=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O6/c1-21(2,3)29-20(25)22(13-8-14-24)17-11-7-12-18(19(17)23(26)27)28-15-16-9-5-4-6-10-16/h4-7,9-12,24H,8,13-15H2,1-3H3