3-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-yl-piperazin-1-yl]methyl]chromen-4-one

Systemtic Name: 3-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-yl-piperazin-1-yl]methyl]chromen-4-one Openeye Name: 3-[[(3S)-3-(2-hydroxyethyl)-4-isopropyl-piperazin-1-yl]methyl]chromen-4-one CAS Name: 3-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-yl-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 3-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-ylpiperazin-1-yl]methyl]chromen-4-one Traditional Name: 3-[[(3S)-3-(2-hydroxyethyl)-4-isopropyl-piperazino]methyl]chromone Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1CCO)CC2=COC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)N1CCN(C[C@@H]1CCO)CC2=COC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H26N2O3/c1-14(2)21-9-8-20(12-16(21)7-10-22)11-15-13-24-18-6-4-3-5-17(18)19(15)23/h3-6,13-14,16,22H,7-12H2,1-2H3/t16-/m0/s1