3-(4-tert-butylphenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide

Systemtic Name: 3-(4-tert-butylphenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide Openeye Name: 3-(4-tert-butylphenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide CAS Name: 3-(4-tert-butylphenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide IUPAC Name: 3-(4-tert-butylphenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide Traditional Name: 3-(4-tert-butylphenyl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propionamide Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C22H27NO3/c1-22(2,3)17-11-8-16(9-12-17)10-13-21(24)23-14-18-15-25-19-6-4-5-7-20(19)26-18/h4-9,11-12,18H,10,13-15H2,1-3H3,(H,23,24)/t18-/m0/s1