(E)-1-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(3-hydroxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(3-hydroxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(3-hydroxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(3-hydroxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(3-hydroxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydro-$b-carbolin-2-yl]-3-(3-hydroxyphenyl)prop-2-en-1-one Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=C1C3=CC=CC=C3N2)C4=CC5=C(C=C4)OCO5)C(=O)C=CC6=CC(=CC=C6)O

Isomeric SMILES

C1CN(C(C2=C1C3=CC=CC=C3N2)C4=CC5=C(C=C4)OCO5)C(=O)/C=C/C6=CC(=CC=C6)O

InChI

InChI=1S/C27H22N2O4/c30-19-5-3-4-17(14-19)8-11-25(31)29-13-12-21-20-6-1-2-7-22(20)28-26(21)27(29)18-9-10-23-24(15-18)33-16-32-23/h1-11,14-15,27-28,30H,12-13,16H2/b11-8+