(2-methoxy-5-nitro-phenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid (2-methoxy-5-nitro-benzyl) ester Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23N3O6/c1-13(2)22-20(25)21-11-14-4-6-15(7-5-14)19(24)29-12-16-10-17(23(26)27)8-9-18(16)28-3/h4-10,13H,11-12H2,1-3H3,(H2,21,22,25)