tert-butyl N-[4-[(2,3-dimethyl-5-nitro-6-phenoxy-pyridin-4-yl)amino]butyl]carbamate

Systemtic Name: tert-butyl N-[4-[(2,3-dimethyl-5-nitro-6-phenoxy-pyridin-4-yl)amino]butyl]carbamate Openeye Name: tert-butyl N-[4-[(2,3-dimethyl-5-nitro-6-phenoxy-4-pyridyl)amino]butyl]carbamate CAS Name: N-[4-[(2,3-dimethyl-5-nitro-6-phenoxy-4-pyridinyl)amino]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(2,3-dimethyl-5-nitro-6-phenoxypyridin-4-yl)amino]butyl]carbamate Traditional Name: N-[4-[(2,3-dimethyl-5-nitro-6-phenoxy-4-pyridyl)amino]butyl]carbamic acid tert-butyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N=C1C)OC2=CC=CC=C2)[N+](=O)[O-])NCCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=C(N=C1C)OC2=CC=CC=C2)[N+](=O)[O-])NCCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C22H30N4O5/c1-15-16(2)25-20(30-17-11-7-6-8-12-17)19(26(28)29)18(15)23-13-9-10-14-24-21(27)31-22(3,4)5/h6-8,11-12H,9-10,13-14H2,1-5H3,(H,23,25)(H,24,27)