1-cyclohexyl-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-4-oxidanylidene-5-pyrrolidin-1-ylcarbonyl-pyridine-3-carboxamide

Systemtic Name: 1-cyclohexyl-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-4-oxidanylidene-5-pyrrolidin-1-ylcarbonyl-pyridine-3-carboxamide Openeye Name: 1-cyclohexyl-N-[[(1S)-isochroman-1-yl]methyl]-4-oxo-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide CAS Name: 1-cyclohexyl-N-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-4-oxo-5-[oxo(1-pyrrolidinyl)methyl]-3-pyridinecarboxamide IUPAC Name: 1-cyclohexyl-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-4-oxo-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide Traditional Name: 1-cyclohexyl-N-[[(1S)-isochroman-1-yl]methyl]-4-keto-5-(pyrrolidine-1-carbonyl)nicotinamide Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C=C(C(=O)C(=C2)C(=O)N3CCCC3)C(=O)NCC4C5=CC=CC=C5CCO4

Isomeric SMILES

C1CCC(CC1)N2C=C(C(=O)C(=C2)C(=O)N3CCCC3)C(=O)NC[C@@H]4C5=CC=CC=C5CCO4

InChI

InChI=1S/C27H33N3O4/c31-25-22(26(32)28-16-24-21-11-5-4-8-19(21)12-15-34-24)17-30(20-9-2-1-3-10-20)18-23(25)27(33)29-13-6-7-14-29/h4-5,8,11,17-18,20,24H,1-3,6-7,9-10,12-16H2,(H,28,32)/t24-/m1/s1