N-[(4-tert-butylphenyl)methyl]-5-morpholin-4-yl-2-nitro-aniline

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-5-morpholin-4-yl-2-nitro-aniline Openeye Name: N-[(4-tert-butylphenyl)methyl]-5-morpholino-2-nitro-aniline CAS Name: N-[(4-tert-butylphenyl)methyl]-5-(4-morpholinyl)-2-nitroaniline IUPAC Name: N-[(4-tert-butylphenyl)methyl]-5-morpholin-4-yl-2-nitroaniline Traditional Name: (4-tert-butylbenzyl)-(5-morpholino-2-nitro-phenyl)amine Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O3/c1-21(2,3)17-6-4-16(5-7-17)15-22-19-14-18(8-9-20(19)24(25)26)23-10-12-27-13-11-23/h4-9,14,22H,10-13,15H2,1-3H3