methyl 7-(1,3-benzodioxol-4-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate

Systemtic Name: methyl 7-(1,3-benzodioxol-4-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate Openeye Name: methyl 7-(1,3-benzodioxol-4-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate CAS Name: 7-(1,3-benzodioxol-4-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylic acid methyl ester IUPAC Name: methyl 7-(1,3-benzodioxol-4-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate Traditional Name: 7-(1,3-benzodioxol-4-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylic acid methyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC2C1C(=CCC2)C3=C4C(=CC=C3)OCO4

Isomeric SMILES

COC(=O)N1CCC2C1C(=CCC2)C3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C17H19NO4/c1-20-17(19)18-9-8-11-4-2-5-12(15(11)18)13-6-3-7-14-16(13)22-10-21-14/h3,5-7,11,15H,2,4,8-10H2,1H3