(3-nitrophenyl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (3-nitrophenyl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate Openeye Name: (3-nitrophenyl)methyl 2-[(4-butoxybenzoyl)amino]acetate CAS Name: 2-[[(4-butoxyphenyl)-oxomethyl]amino]acetic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 2-[(4-butoxybenzoyl)amino]acetate Traditional Name: 2-[(4-butoxybenzoyl)amino]acetic acid (3-nitrobenzyl) ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-2-3-11-27-18-9-7-16(8-10-18)20(24)21-13-19(23)28-14-15-5-4-6-17(12-15)22(25)26/h4-10,12H,2-3,11,13-14H2,1H3,(H,21,24)