methyl (3aR,4S,11bS)-4,7-diethanoyl-3-(phenylmethyl)-2,3a,4,5-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate

Systemtic Name: methyl (3aR,4S,11bS)-4,7-diethanoyl-3-(phenylmethyl)-2,3a,4,5-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate Openeye Name: methyl (3aR,4S,11bS)-4,7-diacetyl-3-benzyl-2,3a,4,5-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate CAS Name: (3aR,4S,11bS)-4,7-diacetyl-3-(phenylmethyl)-2,3a,4,5-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester IUPAC Name: methyl (3aR,4S,11bS)-4,7-diacetyl-3-benzyl-2,3a,4,5-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate Traditional Name: (3aR,4S,11bS)-4,7-diacetyl-3-benzyl-2,3a,4,5-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester Formula: C27H28N2O4 MolecularWeight: 444.52222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC(=C2C3(C1N(CC3)CC4=CC=CC=C4)C5=CC=CC=C5N2C(=O)C)C(=O)OC

Isomeric SMILES

CC(=O)[C@H]1CC(=C2[C@]3([C@@H]1N(CC3)CC4=CC=CC=C4)C5=CC=CC=C5N2C(=O)C)C(=O)OC

InChI

InChI=1S/C27H28N2O4/c1-17(30)20-15-21(26(32)33-3)25-27(22-11-7-8-12-23(22)29(25)18(2)31)13-14-28(24(20)27)16-19-9-5-4-6-10-19/h4-12,20,24H,13-16H2,1-3H3/t20-,24-,27+/m1/s1