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

Systemtic Name: 2-cyclopropyl-N-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclopropyl-N-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-(4-fluorobenzyl)-1-keto-3-(3-methoxyphenyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H25FN2O3 MolecularWeight: 444.497403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCC5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCC5=CC=C(C=C5)F

InChI

InChI=1S/C27H25FN2O3/c1-33-21-6-4-5-18(15-21)25-24(26(31)29-16-17-9-11-19(28)12-10-17)22-7-2-3-8-23(22)27(32)30(25)20-13-14-20/h2-12,15,20,24-25H,13-14,16H2,1H3,(H,29,31)