4-[[(2S)-1-oxidanylbutan-2-yl]amino]xanthen-9-one

Systemtic Name: 4-[[(2S)-1-oxidanylbutan-2-yl]amino]xanthen-9-one Openeye Name: 4-[[(1S)-1-(hydroxymethyl)propyl]amino]xanthen-9-one CAS Name: 4-[[(2S)-1-hydroxybutan-2-yl]amino]-9-xanthenone IUPAC Name: 4-[[(2S)-1-hydroxybutan-2-yl]amino]xanthen-9-one Traditional Name: 4-[[(1S)-1-methylolpropyl]amino]xanthone Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=CC=CC2=C1OC3=CC=CC=C3C2=O

Isomeric SMILES

CC[C@@H](CO)NC1=CC=CC2=C1OC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H17NO3/c1-2-11(10-19)18-14-8-5-7-13-16(20)12-6-3-4-9-15(12)21-17(13)14/h3-9,11,18-19H,2,10H2,1H3/t11-/m0/s1