ethyl 6-bromanyl-2-[(cyclohexylamino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-[(cyclohexylamino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(cyclohexylamino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate CAS Name: 6-bromo-2-[(cyclohexylamino)methyl]-5-methoxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(cyclohexylamino)methyl]-5-methoxy-1-phenylindole-3-carboxylate Traditional Name: 6-bromo-2-[(cyclohexylamino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C25H29BrN2O3 MolecularWeight: 485.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CNC4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CNC4CCCCC4

InChI

InChI=1S/C25H29BrN2O3/c1-3-31-25(29)24-19-14-23(30-2)20(26)15-21(19)28(18-12-8-5-9-13-18)22(24)16-27-17-10-6-4-7-11-17/h5,8-9,12-15,17,27H,3-4,6-7,10-11,16H2,1-2H3