4-(2-methoxyphenyl)-6-methyl-8-(3-oxidanylprop-1-ynyl)pyrrolo[3,4-e]indole-1,3-dione

Systemtic Name: 4-(2-methoxyphenyl)-6-methyl-8-(3-oxidanylprop-1-ynyl)pyrrolo[3,4-e]indole-1,3-dione Openeye Name: 8-(3-hydroxyprop-1-ynyl)-4-(2-methoxyphenyl)-6-methyl-pyrrolo[3,4-e]indole-1,3-dione CAS Name: 8-(3-hydroxyprop-1-ynyl)-4-(2-methoxyphenyl)-6-methylpyrrolo[3,4-e]indole-1,3-dione IUPAC Name: 8-(3-hydroxyprop-1-ynyl)-4-(2-methoxyphenyl)-6-methylpyrrolo[3,4-e]indole-1,3-dione Traditional Name: 8-(3-hydroxyprop-1-ynyl)-4-(2-methoxyphenyl)-6-methyl-pyrrol[3,4-e]indole-1,3-quinone Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=C(C3=C2C(=O)NC3=O)C4=CC=CC=C4OC)C#CCO

Isomeric SMILES

CN1C=C(C2=C1C=C(C3=C2C(=O)NC3=O)C4=CC=CC=C4OC)C#CCO

InChI

InChI=1S/C21H16N2O4/c1-23-11-12(6-5-9-24)17-15(23)10-14(13-7-3-4-8-16(13)27-2)18-19(17)21(26)22-20(18)25/h3-4,7-8,10-11,24H,9H2,1-2H3,(H,22,25,26)