2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxidanylidene-N-(3-pyrrolidin-1-ylpropyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxidanylidene-N-(3-pyrrolidin-1-ylpropyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxo-N-(3-pyrrolidin-1-ylpropyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxo-N-[3-(1-pyrrolidinyl)propyl]-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxo-N-(3-pyrrolidin-1-ylpropyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-(4-fluorobenzyl)-1-keto-3-(4-methoxyphenyl)-N-(3-pyrrolidinopropyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C31H34FN3O3 MolecularWeight: 515.618363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F)C(=O)NCCCN5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F)C(=O)NCCCN5CCCC5

InChI

InChI=1S/C31H34FN3O3/c1-38-25-15-11-23(12-16-25)29-28(30(36)33-17-6-20-34-18-4-5-19-34)26-7-2-3-8-27(26)31(37)35(29)21-22-9-13-24(32)14-10-22/h2-3,7-16,28-29H,4-6,17-21H2,1H3,(H,33,36)