methyl 2-[(5-chloranyl-2-nitro-phenyl)-(3-methoxypropyl)amino]ethanoate

Systemtic Name: methyl 2-[(5-chloranyl-2-nitro-phenyl)-(3-methoxypropyl)amino]ethanoate Openeye Name: methyl 2-[5-chloro-N-(3-methoxypropyl)-2-nitro-anilino]acetate CAS Name: 2-[5-chloro-N-(3-methoxypropyl)-2-nitroanilino]acetic acid methyl ester IUPAC Name: methyl 2-[5-chloro-N-(3-methoxypropyl)-2-nitroanilino]acetate Traditional Name: 2-[5-chloro-N-(3-methoxypropyl)-2-nitro-anilino]acetic acid methyl ester Formula: C13H17ClN2O5 MolecularWeight: 316.73748

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC(=O)OC)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

COCCCN(CC(=O)OC)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H17ClN2O5/c1-20-7-3-6-15(9-13(17)21-2)12-8-10(14)4-5-11(12)16(18)19/h4-5,8H,3,6-7,9H2,1-2H3