(phenylmethyl) 2-methyl-5-(3-pyrrolidin-1-ylbutan-2-yloxy)-1H-indole-3-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-5-(3-pyrrolidin-1-ylbutan-2-yloxy)-1H-indole-3-carboxylate Openeye Name: benzyl 2-methyl-5-(1-methyl-2-pyrrolidin-1-yl-propoxy)-1H-indole-3-carboxylate CAS Name: 2-methyl-5-[3-(1-pyrrolidinyl)butan-2-yloxy]-1H-indole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-5-(3-pyrrolidin-1-ylbutan-2-yloxy)-1H-indole-3-carboxylate Traditional Name: 2-methyl-5-(1-methyl-2-pyrrolidino-propoxy)-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)OC(C)C(C)N3CCCC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OC(C)C(C)N3CCCC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H30N2O3/c1-17-24(25(28)29-16-20-9-5-4-6-10-20)22-15-21(11-12-23(22)26-17)30-19(3)18(2)27-13-7-8-14-27/h4-6,9-12,15,18-19,26H,7-8,13-14,16H2,1-3H3