2-(1,3-benzodioxol-5-ylmethyl)-1-(3-ethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(3-ethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(3-ethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(3-ethoxyphenyl)-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(3-ethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 1-m-phenetyl-2-piperonyl-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C27H21NO6 MolecularWeight: 455.45874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)OC6=CC=CC=C6C3=O

Isomeric SMILES

CCOC1=CC=CC(=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)OC6=CC=CC=C6C3=O

InChI

InChI=1S/C27H21NO6/c1-2-31-18-7-5-6-17(13-18)24-23-25(29)19-8-3-4-9-20(19)34-26(23)27(30)28(24)14-16-10-11-21-22(12-16)33-15-32-21/h3-13,24H,2,14-15H2,1H3