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

Systemtic Name: methyl 3-(2-methylpropanoyl)-1-(naphthalen-2-ylmethyl)-2-propyl-indole-6-carboxylate Openeye Name: methyl 3-(2-methylpropanoyl)-1-(2-naphthylmethyl)-2-propyl-indole-6-carboxylate CAS Name: 3-(2-methyl-1-oxopropyl)-1-(2-naphthalenylmethyl)-2-propyl-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(2-methylpropanoyl)-1-(naphthalen-2-ylmethyl)-2-propylindole-6-carboxylate Traditional Name: 3-isobutyryl-1-(2-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=CC4=CC=CC=C4C=C3)C=C(C=C2)C(=O)OC)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC4=CC=CC=C4C=C3)C=C(C=C2)C(=O)OC)C(=O)C(C)C

InChI

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