tert-butyl (3aS,7aS)-3a-(3-methoxy-4-propan-2-yloxy-phenyl)-3,4,5,7a-tetrahydro-2H-indole-1-carboxylate

Systemtic Name: tert-butyl (3aS,7aS)-3a-(3-methoxy-4-propan-2-yloxy-phenyl)-3,4,5,7a-tetrahydro-2H-indole-1-carboxylate Openeye Name: tert-butyl (3aS,7aS)-3a-(4-isopropoxy-3-methoxy-phenyl)-3,4,5,7a-tetrahydro-2H-indole-1-carboxylate CAS Name: (3aS,7aS)-3a-(3-methoxy-4-propan-2-yloxyphenyl)-3,4,5,7a-tetrahydro-2H-indole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3aS,7aS)-3a-(3-methoxy-4-propan-2-yloxyphenyl)-3,4,5,7a-tetrahydro-2H-indole-1-carboxylate Traditional Name: (3aS,7aS)-3a-(4-isopropoxy-3-methoxy-phenyl)-3,4,5,7a-tetrahydro-2H-indole-1-carboxylic acid tert-butyl ester Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C23CCC=CC2N(CC3)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)[C@@]23CCC=C[C@@H]2N(CC3)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C23H33NO4/c1-16(2)27-18-11-10-17(15-19(18)26-6)23-12-8-7-9-20(23)24(14-13-23)21(25)28-22(3,4)5/h7,9-11,15-16,20H,8,12-14H2,1-6H3/t20-,23-/m0/s1