N-[(3R,4S)-4-(4-methoxyphenyl)-1-propyl-pyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(3R,4S)-4-(4-methoxyphenyl)-1-propyl-pyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(3R,4S)-4-(4-methoxyphenyl)-1-propyl-pyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(3R,4S)-4-(4-methoxyphenyl)-1-propyl-3-pyrrolidinyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(3R,4S)-4-(4-methoxyphenyl)-1-propylpyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(3R,4S)-4-(4-methoxyphenyl)-1-propyl-pyrrolidin-3-yl]-piperonylamide Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC(C(C1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCN1C[C@@H]([C@H](C1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H26N2O4/c1-3-10-24-12-18(15-4-7-17(26-2)8-5-15)19(13-24)23-22(25)16-6-9-20-21(11-16)28-14-27-20/h4-9,11,18-19H,3,10,12-14H2,1-2H3,(H,23,25)/t18-,19+/m1/s1