methyl 1-(chloromethyl)-6,7-diethoxy-3,4-dihydro-2H-isoquinoline-1-carboxylate

Systemtic Name: methyl 1-(chloromethyl)-6,7-diethoxy-3,4-dihydro-2H-isoquinoline-1-carboxylate Openeye Name: methyl 1-(chloromethyl)-6,7-diethoxy-3,4-dihydro-2H-isoquinoline-1-carboxylate CAS Name: 1-(chloromethyl)-6,7-diethoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid methyl ester IUPAC Name: methyl 1-(chloromethyl)-6,7-diethoxy-3,4-dihydro-2H-isoquinoline-1-carboxylate Traditional Name: 1-(chloromethyl)-6,7-diethoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid methyl ester Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CCNC2(CCl)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CCNC2(CCl)C(=O)OC)OCC

InChI

InChI=1S/C16H22ClNO4/c1-4-21-13-8-11-6-7-18-16(10-17,15(19)20-3)12(11)9-14(13)22-5-2/h8-9,18H,4-7,10H2,1-3H3