[4-(morpholin-4-ylmethyl)phenyl]-(4-pentan-3-ylpiperazin-1-yl)methanone dihydrochloride

Systemtic Name: [4-(morpholin-4-ylmethyl)phenyl]-(4-pentan-3-ylpiperazin-1-yl)methanone dihydrochloride Openeye Name: [4-(1-ethylpropyl)piperazin-1-yl]-[4-(morpholinomethyl)phenyl]methanone dihydrochloride CAS Name: [4-(4-morpholinylmethyl)phenyl]-(4-pentan-3-yl-1-piperazinyl)methanone dihydrochloride IUPAC Name: [4-(morpholin-4-ylmethyl)phenyl]-(4-pentan-3-ylpiperazin-1-yl)methanone dihydrochloride Traditional Name: [4-(1-ethylpropyl)piperazino]-[4-(morpholinomethyl)phenyl]methanone dihydrochloride Formula: C21H35Cl2N3O2 MolecularWeight: 432.4275

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCOCC3.Cl.Cl

Isomeric SMILES

CCC(CC)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCOCC3.Cl.Cl

InChI

InChI=1S/C21H33N3O2.2ClH/c1-3-20(4-2)23-9-11-24(12-10-23)21(25)19-7-5-18(6-8-19)17-22-13-15-26-16-14-22;;/h5-8,20H,3-4,9-17H2,1-2H3;2*1H