methyl 3-(2-methylpropanoyl)-1-(naphthalen-1-ylmethyl)-2-propyl-indole-6-carboxylate

Systemtic Name: methyl 3-(2-methylpropanoyl)-1-(naphthalen-1-ylmethyl)-2-propyl-indole-6-carboxylate Openeye Name: methyl 3-(2-methylpropanoyl)-1-(1-naphthylmethyl)-2-propyl-indole-6-carboxylate CAS Name: 3-(2-methyl-1-oxopropyl)-1-(1-naphthalenylmethyl)-2-propyl-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(2-methylpropanoyl)-1-(naphthalen-1-ylmethyl)-2-propylindole-6-carboxylate Traditional Name: 3-isobutyryl-1-(1-naphthylmethyl)-2-propyl-indole-6-carboxylic acid methyl ester Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC4=CC=CC=C43)C=C(C=C2)C(=O)OC)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC4=CC=CC=C43)C=C(C=C2)C(=O)OC)C(=O)C(C)C

InChI

InChI=1S/C28H29NO3/c1-5-9-24-26(27(30)18(2)3)23-15-14-20(28(31)32-4)16-25(23)29(24)17-21-12-8-11-19-10-6-7-13-22(19)21/h6-8,10-16,18H,5,9,17H2,1-4H3