(4-propan-2-ylphenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: (4-isopropylphenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid (4-isopropylbenzyl) ester Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO

InChI

InChI=1S/C19H22N2O5/c1-13(2)15-5-3-14(4-6-15)12-26-19(23)17-11-16(21(24)25)7-8-18(17)20-9-10-22/h3-8,11,13,20,22H,9-10,12H2,1-2H3