ethyl 8-azanyl-5-bromanyl-7-(2-chloranylethanoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 8-azanyl-5-bromanyl-7-(2-chloranylethanoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 8-amino-5-bromo-7-(2-chloroacetyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 8-amino-5-bromo-7-(2-chloro-1-oxoethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 8-amino-5-bromo-7-(2-chloroacetyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 8-amino-5-bromo-7-(2-chloroacetyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C14H16BrClN2O3 MolecularWeight: 375.64544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C=C(C(=C2C1)N)C(=O)CCl)Br

Isomeric SMILES

CCOC(=O)N1CCC2=C(C=C(C(=C2C1)N)C(=O)CCl)Br

InChI

InChI=1S/C14H16BrClN2O3/c1-2-21-14(20)18-4-3-8-10(7-18)13(17)9(5-11(8)15)12(19)6-16/h5H,2-4,6-7,17H2,1H3