N-(2-chloroethyl)-7-methoxy-1-phenyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-(2-chloroethyl)-7-methoxy-1-phenyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6-benzyloxy-N-(2-chloroethyl)-7-methoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-(2-chloroethyl)-7-methoxy-1-phenyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-(2-chloroethyl)-7-methoxy-1-phenyl-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6-benzoxy-N-(2-chloroethyl)-7-methoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C26H27ClN2O3 MolecularWeight: 450.95718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CCN(C(C2=C1)C3=CC=CC=C3)C(=O)NCCCl)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2CCN(C(C2=C1)C3=CC=CC=C3)C(=O)NCCCl)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27ClN2O3/c1-31-23-17-22-21(16-24(23)32-18-19-8-4-2-5-9-19)12-15-29(26(30)28-14-13-27)25(22)20-10-6-3-7-11-20/h2-11,16-17,25H,12-15,18H2,1H3,(H,28,30)