N-[2-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-ethyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[2-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-ethyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-oxo-ethyl]-4-isopropoxy-benzamide CAS Name: N-[2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-oxoethyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-oxoethyl]-4-propan-2-yloxybenzamide Traditional Name: N-[2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-keto-ethyl]-4-isopropoxy-benzamide Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NCC(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NCC(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C20H23N3O6/c1-13(2)29-17-9-5-15(6-10-17)20(26)22-12-19(25)21-11-18(24)14-3-7-16(8-4-14)23(27)28/h3-10,13,18,24H,11-12H2,1-2H3,(H,21,25)(H,22,26)