N5-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-4-oxidanylidene-1-(phenylmethyl)-N3-propan-2-yl-pyridine-3,5-dicarboxamide

Systemtic Name: N5-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-4-oxidanylidene-1-(phenylmethyl)-N3-propan-2-yl-pyridine-3,5-dicarboxamide Openeye Name: 1-benzyl-N5-[[(1S)-isochroman-1-yl]methyl]-N3-isopropyl-4-oxo-pyridine-3,5-dicarboxamide CAS Name: N5-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-4-oxo-1-(phenylmethyl)-N3-propan-2-ylpyridine-3,5-dicarboxamide IUPAC Name: 1-benzyl-5-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-4-oxo-3-N-propan-2-ylpyridine-3,5-dicarboxamide Traditional Name: 1-benzyl-N'-[[(1S)-isochroman-1-yl]methyl]-N-isopropyl-4-keto-dinicotinamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)NCC2C3=CC=CC=C3CCO2)CC4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)NC[C@@H]2C3=CC=CC=C3CCO2)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4/c1-18(2)29-27(33)23-17-30(15-19-8-4-3-5-9-19)16-22(25(23)31)26(32)28-14-24-21-11-7-6-10-20(21)12-13-34-24/h3-11,16-18,24H,12-15H2,1-2H3,(H,28,32)(H,29,33)/t24-/m1/s1