(phenylmethyl) 2-methyl-5-(4-pyrrolidin-1-ylbutoxy)-1H-indole-3-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-5-(4-pyrrolidin-1-ylbutoxy)-1H-indole-3-carboxylate Openeye Name: benzyl 2-methyl-5-(4-pyrrolidin-1-ylbutoxy)-1H-indole-3-carboxylate CAS Name: 2-methyl-5-[4-(1-pyrrolidinyl)butoxy]-1H-indole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-5-(4-pyrrolidin-1-ylbutoxy)-1H-indole-3-carboxylate Traditional Name: 2-methyl-5-(4-pyrrolidinobutoxy)-1H-indole-3-carboxylic acid benzyl ester Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OCCCCN3CCCC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OCCCCN3CCCC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H30N2O3/c1-19-24(25(28)30-18-20-9-3-2-4-10-20)22-17-21(11-12-23(22)26-19)29-16-8-7-15-27-13-5-6-14-27/h2-4,9-12,17,26H,5-8,13-16,18H2,1H3