N-[2-[4-(azepan-1-yl)phenyl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(1-azepanyl)phenyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-piperonylamide Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)CCNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)CCNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N2O3/c25-22(18-7-10-20-21(15-18)27-16-26-20)23-12-11-17-5-8-19(9-6-17)24-13-3-1-2-4-14-24/h5-10,15H,1-4,11-14,16H2,(H,23,25)