4-tert-butyl-N-(3-morpholin-4-ylphenyl)-2-nitro-aniline

Systemtic Name: 4-tert-butyl-N-(3-morpholin-4-ylphenyl)-2-nitro-aniline Openeye Name: 4-tert-butyl-N-(3-morpholinophenyl)-2-nitro-aniline CAS Name: 4-tert-butyl-N-[3-(4-morpholinyl)phenyl]-2-nitroaniline IUPAC Name: 4-tert-butyl-N-(3-morpholin-4-ylphenyl)-2-nitroaniline Traditional Name: (4-tert-butyl-2-nitro-phenyl)-(3-morpholinophenyl)amine Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O3/c1-20(2,3)15-7-8-18(19(13-15)23(24)25)21-16-5-4-6-17(14-16)22-9-11-26-12-10-22/h4-8,13-14,21H,9-12H2,1-3H3