N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)-1-(3-methylbutanoyl)pyrrolidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)-1-(3-methylbutanoyl)pyrrolidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)-1-(3-methylbutanoyl)pyrrolidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)-1-(3-methyl-1-oxobutyl)-3-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)-1-(3-methylbutanoyl)pyrrolidine-3-carboxamide Traditional Name: 1-isovaleryl-4-(4-methoxyphenyl)-N-piperonyl-pyrrolidine-3-carboxamide Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CC(C(C1)C(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)CC(=O)N1CC(C(C1)C(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H30N2O5/c1-16(2)10-24(28)27-13-20(18-5-7-19(30-3)8-6-18)21(14-27)25(29)26-12-17-4-9-22-23(11-17)32-15-31-22/h4-9,11,16,20-21H,10,12-15H2,1-3H3,(H,26,29)