N-[3-(butan-2-ylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(butan-2-ylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-pyrrolidin-1-yl-3-(sec-butylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[(butan-2-ylamino)-oxomethyl]-4-(1-pyrrolidinyl)phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(butan-2-ylcarbamoyl)-4-pyrrolidin-1-ylphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-pyrrolidino-3-(sec-butylcarbamoyl)phenyl]-piperonylamide Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)N4CCCC4

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)N4CCCC4

InChI

InChI=1S/C23H27N3O4/c1-3-15(2)24-23(28)18-13-17(7-8-19(18)26-10-4-5-11-26)25-22(27)16-6-9-20-21(12-16)30-14-29-20/h6-9,12-13,15H,3-5,10-11,14H2,1-2H3,(H,24,28)(H,25,27)