ethyl 6-bromanyl-4-(dimethylaminomethyl)-5-oxidanyl-1-phenyl-2-(piperidin-1-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-(dimethylaminomethyl)-5-oxidanyl-1-phenyl-2-(piperidin-1-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-phenyl-2-(1-piperidylmethyl)indole-3-carboxylate CAS Name: 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-phenyl-2-(1-piperidinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-phenyl-2-(piperidin-1-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-phenyl-2-(piperidinomethyl)indole-3-carboxylic acid ethyl ester Formula: C26H32BrN3O3 MolecularWeight: 514.45458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC=CC=C3)CN4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC=CC=C3)CN4CCCCC4

InChI

InChI=1S/C26H32BrN3O3/c1-4-33-26(32)24-22(17-29-13-9-6-10-14-29)30(18-11-7-5-8-12-18)21-15-20(27)25(31)19(23(21)24)16-28(2)3/h5,7-8,11-12,15,31H,4,6,9-10,13-14,16-17H2,1-3H3