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

Systemtic Name: tert-butyl N-[4-[(5-methyl-2-nitro-phenyl)amino]butyl]carbamate Openeye Name: tert-butyl N-[4-(5-methyl-2-nitro-anilino)butyl]carbamate CAS Name: N-[4-(5-methyl-2-nitroanilino)butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(5-methyl-2-nitroanilino)butyl]carbamate Traditional Name: N-[4-(5-methyl-2-nitro-anilino)butyl]carbamic acid tert-butyl ester Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])NCCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])NCCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C16H25N3O4/c1-12-7-8-14(19(21)22)13(11-12)17-9-5-6-10-18-15(20)23-16(2,3)4/h7-8,11,17H,5-6,9-10H2,1-4H3,(H,18,20)