ethyl 6-bromanyl-5-methoxy-2-methyl-1-[2-oxidanyl-3-(propan-2-ylamino)propyl]indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-methoxy-2-methyl-1-[2-oxidanyl-3-(propan-2-ylamino)propyl]indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-[2-hydroxy-3-(isopropylamino)propyl]-5-methoxy-2-methyl-indole-3-carboxylate CAS Name: 6-bromo-1-[2-hydroxy-3-(propan-2-ylamino)propyl]-5-methoxy-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-[2-hydroxy-3-(propan-2-ylamino)propyl]-5-methoxy-2-methylindole-3-carboxylate Traditional Name: 6-bromo-1-[2-hydroxy-3-(isopropylamino)propyl]-5-methoxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C19H27BrN2O4 MolecularWeight: 427.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)CC(CNC(C)C)O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)CC(CNC(C)C)O)C

InChI

InChI=1S/C19H27BrN2O4/c1-6-26-19(24)18-12(4)22(10-13(23)9-21-11(2)3)16-8-15(20)17(25-5)7-14(16)18/h7-8,11,13,21,23H,6,9-10H2,1-5H3