methyl 3-chloranyl-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]-5-nitro-benzoate

Systemtic Name: methyl 3-chloranyl-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]-5-nitro-benzoate Openeye Name: methyl 3-chloro-4-[5-(3-methylisoxazol-5-yl)pentoxy]-5-nitro-benzoate CAS Name: 3-chloro-4-[5-(3-methyl-5-isoxazolyl)pentoxy]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-chloro-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]-5-nitrobenzoate Traditional Name: 3-chloro-4-[5-(3-methylisoxazol-5-yl)pentoxy]-5-nitro-benzoic acid methyl ester Formula: C17H19ClN2O6 MolecularWeight: 382.79556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CCCCCOC2=C(C=C(C=C2Cl)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)CCCCCOC2=C(C=C(C=C2Cl)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H19ClN2O6/c1-11-8-13(26-19-11)6-4-3-5-7-25-16-14(18)9-12(17(21)24-2)10-15(16)20(22)23/h8-10H,3-7H2,1-2H3