4-[4-[(2R)-2-oxidanyl-3-(pentylamino)propoxy]phenyl]butan-2-one

Systemtic Name: 4-[4-[(2R)-2-oxidanyl-3-(pentylamino)propoxy]phenyl]butan-2-one Openeye Name: 4-[4-[(2R)-2-hydroxy-3-(pentylamino)propoxy]phenyl]butan-2-one CAS Name: 4-[4-[(2R)-2-hydroxy-3-(pentylamino)propoxy]phenyl]-2-butanone IUPAC Name: 4-[4-[(2R)-2-hydroxy-3-(pentylamino)propoxy]phenyl]butan-2-one Traditional Name: 4-[4-[(2R)-3-(amylamino)-2-hydroxy-propoxy]phenyl]butan-2-one Formula: C18H29NO3 MolecularWeight: 307.42776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC(COC1=CC=C(C=C1)CCC(=O)C)O

Isomeric SMILES

CCCCCNC[C@H](COC1=CC=C(C=C1)CCC(=O)C)O

InChI

InChI=1S/C18H29NO3/c1-3-4-5-12-19-13-17(21)14-22-18-10-8-16(9-11-18)7-6-15(2)20/h8-11,17,19,21H,3-7,12-14H2,1-2H3/t17-/m1/s1