ethyl 6-bromanyl-5-methoxy-1-phenyl-2-(piperazin-1-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-methoxy-1-phenyl-2-(piperazin-1-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-5-methoxy-1-phenyl-2-(piperazin-1-ylmethyl)indole-3-carboxylate CAS Name: 6-bromo-5-methoxy-1-phenyl-2-(1-piperazinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-methoxy-1-phenyl-2-(piperazin-1-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-5-methoxy-1-phenyl-2-(piperazinomethyl)indole-3-carboxylic acid ethyl ester Formula: C23H26BrN3O3 MolecularWeight: 472.37484

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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)CN4CCNCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CN4CCNCC4

InChI

InChI=1S/C23H26BrN3O3/c1-3-30-23(28)22-17-13-21(29-2)18(24)14-19(17)27(16-7-5-4-6-8-16)20(22)15-26-11-9-25-10-12-26/h4-8,13-14,25H,3,9-12,15H2,1-2H3