(2S)-3-[(2S)-butan-2-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-3-[(2S)-butan-2-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-[(1S)-1-methylpropyl]-1,2-dihydroquinazolin-4-one CAS Name: (2S)-3-[(2S)-butan-2-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-3-[(2S)-butan-2-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-[(1S)-1-methylpropyl]-1,2-dihydroquinazolin-4-one Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(NC2=CC=CC=C2C1=O)C3=CC4=C(C(=C3)OC)OCO4

Isomeric SMILES

CC[C@H](C)N1[C@H](NC2=CC=CC=C2C1=O)C3=CC4=C(C(=C3)OC)OCO4

InChI

InChI=1S/C20H22N2O4/c1-4-12(2)22-19(21-15-8-6-5-7-14(15)20(22)23)13-9-16(24-3)18-17(10-13)25-11-26-18/h5-10,12,19,21H,4,11H2,1-3H3/t12-,19-/m0/s1