[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-azanyl-4-chloranyl-benzoate Openeye Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H16ClN3O5 MolecularWeight: 389.78974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)Cl)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)Cl)N)OC

InChI

InChI=1S/C18H16ClN3O5/c1-24-14-6-4-10(8-15(14)25-2)17-21-16(27-22-17)9-26-18(23)11-3-5-12(19)13(20)7-11/h3-8H,9,20H2,1-2H3