6-[[butyl-(phenylmethyl)amino]methyl]-2-oxidanylidene-N-(oxolan-2-ylmethyl)-1H-pyridine-3-carboxamide

Systemtic Name: 6-[[butyl-(phenylmethyl)amino]methyl]-2-oxidanylidene-N-(oxolan-2-ylmethyl)-1H-pyridine-3-carboxamide Openeye Name: 6-[[benzyl(butyl)amino]methyl]-2-oxo-N-(tetrahydrofuran-2-ylmethyl)-1H-pyridine-3-carboxamide CAS Name: 6-[[butyl-(phenylmethyl)amino]methyl]-2-oxo-N-(2-oxolanylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: 6-[[benzyl(butyl)amino]methyl]-2-oxo-N-(oxolan-2-ylmethyl)-1H-pyridine-3-carboxamide Traditional Name: 6-[[benzyl(butyl)amino]methyl]-2-keto-N-(tetrahydrofurfuryl)-1H-pyridine-3-carboxamide Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)CC2=CC=C(C(=O)N2)C(=O)NCC3CCCO3

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)CC2=CC=C(C(=O)N2)C(=O)NCC3CCCO3

InChI

InChI=1S/C23H31N3O3/c1-2-3-13-26(16-18-8-5-4-6-9-18)17-19-11-12-21(23(28)25-19)22(27)24-15-20-10-7-14-29-20/h4-6,8-9,11-12,20H,2-3,7,10,13-17H2,1H3,(H,24,27)(H,25,28)