dimethyl (E)-2-(1-carbazol-9-yl-1H-isoquinolin-2-yl)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(1-carbazol-9-yl-1H-isoquinolin-2-yl)but-2-enedioate Openeye Name: dimethyl (E)-2-(1-carbazol-9-yl-1H-isoquinolin-2-yl)but-2-enedioate CAS Name: (E)-2-[1-(9-carbazolyl)-1H-isoquinolin-2-yl]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(1-carbazol-9-yl-1H-isoquinolin-2-yl)but-2-enedioate Traditional Name: (E)-2-(1-carbazol-9-yl-1H-isoquinolin-2-yl)but-2-enedioic acid dimethyl ester Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)N1C=CC2=CC=CC=C2C1N3C4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/N1C=CC2=CC=CC=C2C1N3C4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C27H22N2O4/c1-32-25(30)17-24(27(31)33-2)28-16-15-18-9-3-4-10-19(18)26(28)29-22-13-7-5-11-20(22)21-12-6-8-14-23(21)29/h3-17,26H,1-2H3/b24-17+