(E)-3-(1H-indol-5-yl)-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-prop-2-en-1-one

Systemtic Name: (E)-3-(1H-indol-5-yl)-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-prop-2-en-1-one Openeye Name: (E)-3-(1H-indol-5-yl)-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-prop-2-en-1-one CAS Name: (E)-3-(1H-indol-5-yl)-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-2-propen-1-one IUPAC Name: (E)-3-(1H-indol-5-yl)-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methylprop-2-en-1-one Traditional Name: (E)-3-(1H-indol-5-yl)-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-prop-2-en-1-one Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC2=C(C=C1)NC=C2)C(=O)C3=CC4=C(C(=C3)OC)OCO4

Isomeric SMILES

C/C(=C\C1=CC2=C(C=C1)NC=C2)/C(=O)C3=CC4=C(C(=C3)OC)OCO4

InChI

InChI=1S/C20H17NO4/c1-12(7-13-3-4-16-14(8-13)5-6-21-16)19(22)15-9-17(23-2)20-18(10-15)24-11-25-20/h3-10,21H,11H2,1-2H3/b12-7+