methyl (3aR,11bR)-3-[(Z)-2-iodanylbut-2-enyl]-4-oxidanylidene-2,3a,5,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate

Systemtic Name: methyl (3aR,11bR)-3-[(Z)-2-iodanylbut-2-enyl]-4-oxidanylidene-2,3a,5,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate Openeye Name: methyl (3aR,11bR)-3-[(Z)-2-iodobut-2-enyl]-4-oxo-2,3a,5,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate CAS Name: (3aR,11bR)-3-[(Z)-2-iodobut-2-enyl]-4-oxo-2,3a,5,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester IUPAC Name: methyl (3aR,11bR)-3-[(Z)-2-iodobut-2-enyl]-4-oxo-2,3a,5,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate Traditional Name: (3aR,11bR)-3-[(Z)-2-iodobut-2-enyl]-4-keto-2,3a,5,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester Formula: C20H21IN2O3 MolecularWeight: 464.29681

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(CN1CCC23C1C(=O)CC(=C2NC4=CC=CC=C34)C(=O)OC)I

Isomeric SMILES

C/C=C(/CN1CC[C@@]23[C@@H]1C(=O)CC(=C2NC4=CC=CC=C34)C(=O)OC)\I

InChI

InChI=1S/C20H21IN2O3/c1-3-12(21)11-23-9-8-20-14-6-4-5-7-15(14)22-17(20)13(19(25)26-2)10-16(24)18(20)23/h3-7,18,22H,8-11H2,1-2H3/b12-3-/t18-,20-/m0/s1