N-[3-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-3-oxidanylidene-propyl]-2-methoxy-benzamide

Systemtic Name: N-[3-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-3-oxidanylidene-propyl]-2-methoxy-benzamide Openeye Name: N-[3-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-3-oxo-propyl]-2-methoxy-benzamide CAS Name: N-[3-[2-(4,5-dimethoxy-2-nitrophenyl)ethylamino]-3-oxopropyl]-2-methoxybenzamide IUPAC Name: N-[3-[2-(4,5-dimethoxy-2-nitrophenyl)ethylamino]-3-oxopropyl]-2-methoxybenzamide Traditional Name: N-[3-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-3-keto-propyl]-2-methoxy-benzamide Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCCC(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCCC(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H25N3O7/c1-29-17-7-5-4-6-15(17)21(26)23-11-9-20(25)22-10-8-14-12-18(30-2)19(31-3)13-16(14)24(27)28/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)(H,23,26)