methyl (3aS,5R,11bR)-5-deuterio-5-[2-(phenylcarbonyloxy)ethyl]-3-(phenylmethyl)-2,3a,4,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate

Systemtic Name: methyl (3aS,5R,11bR)-5-deuterio-5-[2-(phenylcarbonyloxy)ethyl]-3-(phenylmethyl)-2,3a,4,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate Openeye Name: methyl (3aS,5R,11bR)-5-(2-benzoyloxyethyl)-3-benzyl-5-deuterio-2,3a,4,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate CAS Name: (3aS,5R,11bR)-5-(2-benzoyloxyethyl)-5-deuterio-3-(phenylmethyl)-2,3a,4,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester IUPAC Name: methyl (3aS,5R,11bR)-5-(2-benzoyloxyethyl)-3-benzyl-5-deuterio-2,3a,4,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate Traditional Name: (3aS,5R,11bR)-5-(2-benzoyloxyethyl)-3-benzyl-5-deuterio-2,3a,4,7-tetrahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester Formula: C32H32N2O4 MolecularWeight: 509.613642

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C3(CCN(C3CC1CCOC(=O)C4=CC=CC=C4)CC5=CC=CC=C5)C6=CC=CC=C6N2

Isomeric SMILES

[2H][C@@]1(C[C@H]2[C@@]3(CCN2CC4=CC=CC=C4)C5=CC=CC=C5NC3=C1C(=O)OC)CCOC(=O)C6=CC=CC=C6

InChI

InChI=1S/C32H32N2O4/c1-37-31(36)28-24(16-19-38-30(35)23-12-6-3-7-13-23)20-27-32(25-14-8-9-15-26(25)33-29(28)32)17-18-34(27)21-22-10-4-2-5-11-22/h2-15,24,27,33H,16-21H2,1H3/t24-,27-,32+/m0/s1/i24D