2-diethylaminoethyl 6-bromanyl-5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-methyl-indole-3-carboxylate

Systemtic Name: 2-diethylaminoethyl 6-bromanyl-5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-methyl-indole-3-carboxylate Openeye Name: 2-diethylaminoethyl 6-bromo-5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-methyl-indole-3-carboxylate CAS Name: 6-bromo-5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-methyl-3-indolecarboxylic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 6-bromo-5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-methylindole-3-carboxylate Traditional Name: 6-bromo-5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-methyl-indole-3-carboxylic acid 2-diethylaminoethyl ester Formula: C25H31BrN2O5 MolecularWeight: 519.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C)COC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C)COC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H31BrN2O5/c1-6-28(7-2)12-13-32-25(29)24-19-14-23(31-5)20(26)15-21(19)27(3)22(24)16-33-18-10-8-17(30-4)9-11-18/h8-11,14-15H,6-7,12-13,16H2,1-5H3