1-[3-methoxy-4-[(2S)-2-oxidanyl-3-(pentan-3-ylamino)propoxy]phenyl]ethanone

Systemtic Name: 1-[3-methoxy-4-[(2S)-2-oxidanyl-3-(pentan-3-ylamino)propoxy]phenyl]ethanone Openeye Name: 1-[4-[(2S)-3-(1-ethylpropylamino)-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[(2S)-2-hydroxy-3-(pentan-3-ylamino)propoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[(2S)-2-hydroxy-3-(pentan-3-ylamino)propoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[(2S)-3-(1-ethylpropylamino)-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone Formula: C17H27NO4 MolecularWeight: 309.40058

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC(COC1=C(C=C(C=C1)C(=O)C)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO4/c1-5-14(6-2)18-10-15(20)11-22-16-8-7-13(12(3)19)9-17(16)21-4/h7-9,14-15,18,20H,5-6,10-11H2,1-4H3/t15-/m0/s1