methyl (3aS,9bR)-3-methanoyl-9b-prop-2-enyl-1,2,4,5-tetrahydrobenzo[e]indole-3a-carboxylate

Systemtic Name: methyl (3aS,9bR)-3-methanoyl-9b-prop-2-enyl-1,2,4,5-tetrahydrobenzo[e]indole-3a-carboxylate Openeye Name: methyl (3aS,9bR)-9b-allyl-3-formyl-1,2,4,5-tetrahydrobenzo[e]indole-3a-carboxylate CAS Name: (3aS,9bR)-3-formyl-9b-prop-2-enyl-1,2,4,5-tetrahydrobenzo[e]indole-3a-carboxylic acid methyl ester IUPAC Name: methyl (3aS,9bR)-3-formyl-9b-prop-2-enyl-1,2,4,5-tetrahydrobenzo[e]indole-3a-carboxylate Traditional Name: (3aS,9bR)-9b-allyl-3-formyl-1,2,4,5-tetrahydrobenz[e]indole-3a-carboxylic acid methyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CCC3=CC=CC=C3C1(CCN2C=O)CC=C

Isomeric SMILES

COC(=O)[C@]12CCC3=CC=CC=C3[C@]1(CCN2C=O)CC=C

InChI

InChI=1S/C18H21NO3/c1-3-9-17-11-12-19(13-20)18(17,16(21)22-2)10-8-14-6-4-5-7-15(14)17/h3-7,13H,1,8-12H2,2H3/t17-,18-/m1/s1