ethyl 3-bromanyl-4-(pyridin-4-ylmethylamino)benzoate

Systemtic Name: ethyl 3-bromanyl-4-(pyridin-4-ylmethylamino)benzoate Openeye Name: ethyl 3-bromo-4-(4-pyridylmethylamino)benzoate CAS Name: 3-bromo-4-(pyridin-4-ylmethylamino)benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-(pyridin-4-ylmethylamino)benzoate Traditional Name: 3-bromo-4-(4-pyridylmethylamino)benzoic acid ethyl ester Formula: C15H15BrN2O2 MolecularWeight: 335.1958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NCC2=CC=NC=C2)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NCC2=CC=NC=C2)Br

InChI

InChI=1S/C15H15BrN2O2/c1-2-20-15(19)12-3-4-14(13(16)9-12)18-10-11-5-7-17-8-6-11/h3-9,18H,2,10H2,1H3