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

Systemtic Name: ethyl 8-azanyl-7-(2-chloranylethanoyl)-5-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 8-amino-7-(2-chloroacetyl)-5-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 8-amino-7-(2-chloro-1-oxoethyl)-5-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 8-amino-7-(2-chloroacetyl)-5-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 8-amino-7-(2-chloroacetyl)-5-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1)C(=C(C=C2C3=CC=CC=C3)C(=O)CCl)N

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1)C(=C(C=C2C3=CC=CC=C3)C(=O)CCl)N

InChI

InChI=1S/C20H21ClN2O3/c1-2-26-20(25)23-9-8-14-15(13-6-4-3-5-7-13)10-16(18(24)11-21)19(22)17(14)12-23/h3-7,10H,2,8-9,11-12,22H2,1H3