tert-butyl N-methyl-N-[2-nitro-5-(2-piperidin-1-ylphenoxy)phenyl]carbamate

Systemtic Name: tert-butyl N-methyl-N-[2-nitro-5-(2-piperidin-1-ylphenoxy)phenyl]carbamate Openeye Name: tert-butyl N-methyl-N-[2-nitro-5-[2-(1-piperidyl)phenoxy]phenyl]carbamate CAS Name: N-methyl-N-[2-nitro-5-[2-(1-piperidinyl)phenoxy]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-methyl-N-[2-nitro-5-(2-piperidin-1-ylphenoxy)phenyl]carbamate Traditional Name: N-methyl-N-[2-nitro-5-(2-piperidinophenoxy)phenyl]carbamic acid tert-butyl ester Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C1=C(C=CC(=C1)OC2=CC=CC=C2N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C1=C(C=CC(=C1)OC2=CC=CC=C2N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O5/c1-23(2,3)31-22(27)24(4)20-16-17(12-13-18(20)26(28)29)30-21-11-7-6-10-19(21)25-14-8-5-9-15-25/h6-7,10-13,16H,5,8-9,14-15H2,1-4H3