(4-nitrophenyl)methyl 3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)propanoate Openeye Name: (4-nitrophenyl)methyl 3-(2-oxo-3-propyl-benzimidazol-1-yl)propanoate CAS Name: 3-(2-oxo-3-propyl-1-benzimidazolyl)propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(2-oxo-3-propylbenzimidazol-1-yl)propanoate Traditional Name: 3-(2-keto-3-propyl-benzimidazol-1-yl)propionic acid (4-nitrobenzyl) ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5/c1-2-12-21-17-5-3-4-6-18(17)22(20(21)25)13-11-19(24)28-14-15-7-9-16(10-8-15)23(26)27/h3-10H,2,11-14H2,1H3