ethyl 6-bromanyl-1-butyl-5-methoxy-2-(naphthalen-2-yloxymethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-butyl-5-methoxy-2-(naphthalen-2-yloxymethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-butyl-5-methoxy-2-(2-naphthyloxymethyl)indole-3-carboxylate CAS Name: 6-bromo-1-butyl-5-methoxy-2-(2-naphthalenyloxymethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-butyl-5-methoxy-2-(naphthalen-2-yloxymethyl)indole-3-carboxylate Traditional Name: 6-bromo-1-butyl-5-methoxy-2-(2-naphthoxymethyl)indole-3-carboxylic acid ethyl ester Formula: C27H28BrNO4 MolecularWeight: 510.41952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC(=C(C=C2C(=C1COC3=CC4=CC=CC=C4C=C3)C(=O)OCC)OC)Br

Isomeric SMILES

CCCCN1C2=CC(=C(C=C2C(=C1COC3=CC4=CC=CC=C4C=C3)C(=O)OCC)OC)Br

InChI

InChI=1S/C27H28BrNO4/c1-4-6-13-29-23-16-22(28)25(31-3)15-21(23)26(27(30)32-5-2)24(29)17-33-20-12-11-18-9-7-8-10-19(18)14-20/h7-12,14-16H,4-6,13,17H2,1-3H3