[[azanyl-(3,4-dimethoxyphenyl)methyl]amino] 4-bromanylbenzoate

Systemtic Name: [[azanyl-(3,4-dimethoxyphenyl)methyl]amino] 4-bromanylbenzoate Openeye Name: [[amino-(3,4-dimethoxyphenyl)methyl]amino] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [[amino-(3,4-dimethoxyphenyl)methyl]amino] ester IUPAC Name: [[amino-(3,4-dimethoxyphenyl)methyl]amino] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [[amino-(3,4-dimethoxyphenyl)methyl]amino] ester Formula: C16H16BrN2O4- MolecularWeight: 380.21324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[C-](N)NOC(=O)C2=CC=C(C=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C-](N)NOC(=O)C2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C16H16BrN2O4/c1-21-13-8-5-11(9-14(13)22-2)15(18)19-23-16(20)10-3-6-12(17)7-4-10/h3-9,19H,18H2,1-2H3/q-1