1-(carboxymethyl)-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-2-phenethyl-indole-6-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-2-phenethyl-indole-6-carboxylic acid Openeye Name: 1-(carboxymethyl)-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-2-phenethyl-indole-6-carboxylic acid CAS Name: 1-(carboxymethyl)-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-2-phenethyl-6-indolecarboxylic acid IUPAC Name: 1-(carboxymethyl)-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-2-phenethylindole-6-carboxylic acid Traditional Name: 1-(carboxymethyl)-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-2-phenethyl-indole-6-carboxylic acid Formula: C30H27NO5 MolecularWeight: 481.53908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CCC=C2C3=C(N(C4=C3C=CC(=C4)C(=O)O)CC(=O)O)CCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC2=C1CCC=C2C3=C(N(C4=C3C=CC(=C4)C(=O)O)CC(=O)O)CCC5=CC=CC=C5

InChI

InChI=1S/C30H27NO5/c1-36-27-12-6-9-21-22(27)10-5-11-23(21)29-24-15-14-20(30(34)35)17-26(24)31(18-28(32)33)25(29)16-13-19-7-3-2-4-8-19/h2-4,6-9,11-12,14-15,17H,5,10,13,16,18H2,1H3,(H,32,33)(H,34,35)