tert-butyl N-[4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl]phenyl]carbamate CAS Name: N-[4-[2-(2-methyl-5-nitroanilino)-2-oxoethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[2-(2-methyl-5-nitroanilino)-2-oxoethyl]phenyl]carbamate Traditional Name: N-[4-[2-keto-2-(2-methyl-5-nitro-anilino)ethyl]phenyl]carbamic acid tert-butyl ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CC2=CC=C(C=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CC2=CC=C(C=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H23N3O5/c1-13-5-10-16(23(26)27)12-17(13)22-18(24)11-14-6-8-15(9-7-14)21-19(25)28-20(2,3)4/h5-10,12H,11H2,1-4H3,(H,21,25)(H,22,24)