2-butyl-3-(3-chlorophenyl)-1-oxidanylidene-N-(oxolan-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-butyl-3-(3-chlorophenyl)-1-oxidanylidene-N-(oxolan-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-(tetrahydrofuran-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-(2-oxolanylmethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-(oxolan-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-butyl-3-(3-chlorophenyl)-1-keto-N-(tetrahydrofurfuryl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C25H29ClN2O3 MolecularWeight: 440.96236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3CCCO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3CCCO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H29ClN2O3/c1-2-3-13-28-23(17-8-6-9-18(26)15-17)22(20-11-4-5-12-21(20)25(28)30)24(29)27-16-19-10-7-14-31-19/h4-6,8-9,11-12,15,19,22-23H,2-3,7,10,13-14,16H2,1H3,(H,27,29)