N-[2-[(4-fluorophenyl)methylcarbamoyl]phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[2-[(4-fluorophenyl)methylcarbamoyl]phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[2-[(4-fluorophenyl)methylcarbamoyl]phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[2-[[(4-fluorophenyl)methylamino]-oxomethyl]phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[2-[(4-fluorophenyl)methylcarbamoyl]phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[2-[(4-fluorobenzyl)carbamoyl]phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C26H26FN3O4 MolecularWeight: 463.500743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC=C(C=C4)F)OC

InChI

InChI=1S/C26H26FN3O4/c1-33-23-13-18-11-12-30(16-19(18)14-24(23)34-2)26(32)29-22-6-4-3-5-21(22)25(31)28-15-17-7-9-20(27)10-8-17/h3-10,13-14H,11-12,15-16H2,1-2H3,(H,28,31)(H,29,32)