ethyl 2-[butyl-[2-(4-methoxyphenoxy)ethanoyl]amino]-4-nitro-benzoate

Systemtic Name: ethyl 2-[butyl-[2-(4-methoxyphenoxy)ethanoyl]amino]-4-nitro-benzoate Openeye Name: ethyl 2-[butyl-[2-(4-methoxyphenoxy)acetyl]amino]-4-nitro-benzoate CAS Name: 2-[butyl-[2-(4-methoxyphenoxy)-1-oxoethyl]amino]-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-[butyl-[2-(4-methoxyphenoxy)acetyl]amino]-4-nitrobenzoate Traditional Name: 2-[butyl-[2-(4-methoxyphenoxy)acetyl]amino]-4-nitro-benzoic acid ethyl ester Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC)C(=O)COC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCN(C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC)C(=O)COC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H26N2O7/c1-4-6-13-23(21(25)15-31-18-10-8-17(29-3)9-11-18)20-14-16(24(27)28)7-12-19(20)22(26)30-5-2/h7-12,14H,4-6,13,15H2,1-3H3