[5-[2-(3-azanyl-4-tert-butyl-phenyl)ethoxy]-2-nitro-phenyl] N-methylcarbamate

Systemtic Name: [5-[2-(3-azanyl-4-tert-butyl-phenyl)ethoxy]-2-nitro-phenyl] N-methylcarbamate Openeye Name: [5-[2-(3-amino-4-tert-butyl-phenyl)ethoxy]-2-nitro-phenyl] N-methylcarbamate CAS Name: N-methylcarbamic acid [5-[2-(3-amino-4-tert-butylphenyl)ethoxy]-2-nitrophenyl] ester IUPAC Name: [5-[2-(3-amino-4-tert-butylphenyl)ethoxy]-2-nitrophenyl] N-methylcarbamate Traditional Name: N-methylcarbamic acid [5-[2-(3-amino-4-tert-butyl-phenyl)ethoxy]-2-nitro-phenyl] ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)CCOC2=CC(=C(C=C2)[N+](=O)[O-])OC(=O)NC)N

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)CCOC2=CC(=C(C=C2)[N+](=O)[O-])OC(=O)NC)N

InChI

InChI=1S/C20H25N3O5/c1-20(2,3)15-7-5-13(11-16(15)21)9-10-27-14-6-8-17(23(25)26)18(12-14)28-19(24)22-4/h5-8,11-12H,9-10,21H2,1-4H3,(H,22,24)