(4-nitrophenyl)methyl 3-methoxy-4-(3-methylbutoxy)benzoate

Systemtic Name: (4-nitrophenyl)methyl 3-methoxy-4-(3-methylbutoxy)benzoate Openeye Name: (4-nitrophenyl)methyl 4-isopentyloxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(3-methylbutoxy)benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-methoxy-4-(3-methylbutoxy)benzoate Traditional Name: 4-isoamoxy-3-methoxy-benzoic acid (4-nitrobenzyl) ester Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23NO6/c1-14(2)10-11-26-18-9-6-16(12-19(18)25-3)20(22)27-13-15-4-7-17(8-5-15)21(23)24/h4-9,12,14H,10-11,13H2,1-3H3