3-[(3-aminophenyl)-cyclopropyl-methyl]-6-[1-(oxan-4-yl)butan-2-yl]-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(3-aminophenyl)-cyclopropyl-methyl]-6-[1-(oxan-4-yl)butan-2-yl]-2-oxidanyl-pyran-4-one Openeye Name: 3-[(3-aminophenyl)-cyclopropyl-methyl]-2-hydroxy-6-[1-(tetrahydropyran-4-ylmethyl)propyl]pyran-4-one CAS Name: 3-[(3-aminophenyl)-cyclopropylmethyl]-2-hydroxy-6-[1-(4-oxanyl)butan-2-yl]-4-pyranone IUPAC Name: 3-[(3-aminophenyl)-cyclopropylmethyl]-2-hydroxy-6-[1-(oxan-4-yl)butan-2-yl]pyran-4-one Traditional Name: 3-[(3-aminophenyl)-cyclopropyl-methyl]-2-hydroxy-6-[1-(tetrahydropyran-4-ylmethyl)propyl]pyran-4-one Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1CCOCC1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC(=CC=C4)N

Isomeric SMILES

CCC(CC1CCOCC1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC(=CC=C4)N

InChI

InChI=1S/C24H31NO4/c1-2-16(12-15-8-10-28-11-9-15)21-14-20(26)23(24(27)29-21)22(17-6-7-17)18-4-3-5-19(25)13-18/h3-5,13-17,22,27H,2,6-12,25H2,1H3