(E)-3-(4-butoxyphenyl)-1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-butoxyphenyl)-1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-butoxyphenyl)-1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)prop-2-en-1-one CAS Name: (E)-3-(4-butoxyphenyl)-1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)-2-propen-1-one IUPAC Name: (E)-3-(4-butoxyphenyl)-1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)prop-2-en-1-one Traditional Name: (E)-3-(4-butoxyphenyl)-1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-9-yl)prop-2-en-1-one Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC(=O)C2=C3CCN(CC3=C(C4=C2OCO4)OC)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=C3CCN(CC3=C(C4=C2OCO4)OC)C

InChI

InChI=1S/C25H29NO5/c1-4-5-14-29-18-9-6-17(7-10-18)8-11-21(27)22-19-12-13-26(2)15-20(19)23(28-3)25-24(22)30-16-31-25/h6-11H,4-5,12-16H2,1-3H3/b11-8+