N-[4-(azepan-1-yl)phenyl]-2-(cyclopentylamino)ethanamide; ethanedioic acid

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-(cyclopentylamino)ethanamide; ethanedioic acid Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-(cyclopentylamino)acetamide; oxalic acid CAS Name: N-[4-(1-azepanyl)phenyl]-2-(cyclopentylamino)acetamide; oxalic acid IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-(cyclopentylamino)acetamide; oxalic acid Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-(cyclopentylamino)acetamide; oxalic acid Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CNC3CCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CNC3CCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H29N3O.C2H2O4/c23-19(15-20-16-7-3-4-8-16)21-17-9-11-18(12-10-17)22-13-5-1-2-6-14-22;3-1(4)2(5)6/h9-12,16,20H,1-8,13-15H2,(H,21,23);(H,3,4)(H,5,6)