N-[2-[1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[1-(4-isobutoxy-3-methoxy-phenyl)ethylamino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[1-(4-isobutoxy-3-methoxy-phenyl)ethylamino]-2-keto-ethyl]-3-nitro-benzamide Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(C)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(C)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C22H27N3O6/c1-14(2)13-31-19-9-8-16(11-20(19)30-4)15(3)24-21(26)12-23-22(27)17-6-5-7-18(10-17)25(28)29/h5-11,14-15H,12-13H2,1-4H3,(H,23,27)(H,24,26)