morpholin-4-yl-[3-nitro-4-[1-(4-propan-2-ylphenyl)ethylamino]phenyl]methanone

Systemtic Name: morpholin-4-yl-[3-nitro-4-[1-(4-propan-2-ylphenyl)ethylamino]phenyl]methanone Openeye Name: [4-[1-(4-isopropylphenyl)ethylamino]-3-nitro-phenyl]-morpholino-methanone CAS Name: 4-morpholinyl-[3-nitro-4-[1-(4-propan-2-ylphenyl)ethylamino]phenyl]methanone IUPAC Name: morpholin-4-yl-[3-nitro-4-[1-(4-propan-2-ylphenyl)ethylamino]phenyl]methanone Traditional Name: morpholino-[3-nitro-4-(1-p-cumenylethylamino)phenyl]methanone Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-15(2)17-4-6-18(7-5-17)16(3)23-20-9-8-19(14-21(20)25(27)28)22(26)24-10-12-29-13-11-24/h4-9,14-16,23H,10-13H2,1-3H3