azepan-1-yl-[1-(3-phenylpropyl)piperidin-3-yl]methanone; ethanedioic acid

Systemtic Name: azepan-1-yl-[1-(3-phenylpropyl)piperidin-3-yl]methanone; ethanedioic acid Openeye Name: azepan-1-yl-[1-(3-phenylpropyl)-3-piperidyl]methanone; oxalic acid CAS Name: 1-azepanyl-[1-(3-phenylpropyl)-3-piperidinyl]methanone; oxalic acid IUPAC Name: azepan-1-yl-[1-(3-phenylpropyl)piperidin-3-yl]methanone; oxalic acid Traditional Name: azepan-1-yl-[1-(3-phenylpropyl)-3-piperidyl]methanone; oxalic acid Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCCN(C2)CCCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCCN(C2)CCCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H32N2O.C2H2O4/c24-21(23-16-6-1-2-7-17-23)20-13-9-15-22(18-20)14-8-12-19-10-4-3-5-11-19;3-1(4)2(5)6/h3-5,10-11,20H,1-2,6-9,12-18H2;(H,3,4)(H,5,6)