3-[(3-aminophenyl)-cyclopropyl-methyl]-2-oxidanyl-6-pentan-3-yl-pyran-4-one

Systemtic Name: 3-[(3-aminophenyl)-cyclopropyl-methyl]-2-oxidanyl-6-pentan-3-yl-pyran-4-one Openeye Name: 3-[(3-aminophenyl)-cyclopropyl-methyl]-6-(1-ethylpropyl)-2-hydroxy-pyran-4-one CAS Name: 3-[(3-aminophenyl)-cyclopropylmethyl]-2-hydroxy-6-pentan-3-yl-4-pyranone IUPAC Name: 3-[(3-aminophenyl)-cyclopropylmethyl]-2-hydroxy-6-pentan-3-ylpyran-4-one Traditional Name: 3-[(3-aminophenyl)-cyclopropyl-methyl]-6-(1-ethylpropyl)-2-hydroxy-pyran-4-one Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC(=O)C(=C(O1)O)C(C2CC2)C3=CC(=CC=C3)N

Isomeric SMILES

CCC(CC)C1=CC(=O)C(=C(O1)O)C(C2CC2)C3=CC(=CC=C3)N

InChI

InChI=1S/C20H25NO3/c1-3-12(4-2)17-11-16(22)19(20(23)24-17)18(13-8-9-13)14-6-5-7-15(21)10-14/h5-7,10-13,18,23H,3-4,8-9,21H2,1-2H3