6-[1-cyclopropyl-3-(oxan-3-yl)propan-2-yl]-3-[(2-cyclopropylphenyl)amino]-2-oxidanyl-pyran-4-one

Systemtic Name: 6-[1-cyclopropyl-3-(oxan-3-yl)propan-2-yl]-3-[(2-cyclopropylphenyl)amino]-2-oxidanyl-pyran-4-one Openeye Name: 3-(2-cyclopropylanilino)-6-[1-(cyclopropylmethyl)-2-tetrahydropyran-3-yl-ethyl]-2-hydroxy-pyran-4-one CAS Name: 3-(2-cyclopropylanilino)-6-[1-cyclopropyl-3-(3-oxanyl)propan-2-yl]-2-hydroxy-4-pyranone IUPAC Name: 3-(2-cyclopropylanilino)-6-[1-cyclopropyl-3-(oxan-3-yl)propan-2-yl]-2-hydroxypyran-4-one Traditional Name: 3-(2-cyclopropylanilino)-6-[1-(cyclopropylmethyl)-2-tetrahydropyran-3-yl-ethyl]-2-hydroxy-pyran-4-one Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(COC1)CC(CC2CC2)C3=CC(=O)C(=C(O3)O)NC4=CC=CC=C4C5CC5

Isomeric SMILES

C1CC(COC1)CC(CC2CC2)C3=CC(=O)C(=C(O3)O)NC4=CC=CC=C4C5CC5

InChI

InChI=1S/C25H31NO4/c27-22-14-23(19(12-16-7-8-16)13-17-4-3-11-29-15-17)30-25(28)24(22)26-21-6-2-1-5-20(21)18-9-10-18/h1-2,5-6,14,16-19,26,28H,3-4,7-13,15H2