[4-(azepan-1-ylmethyl)phenyl]-[4-(2-methylpropyl)piperazin-1-yl]methanone

Systemtic Name: [4-(azepan-1-ylmethyl)phenyl]-[4-(2-methylpropyl)piperazin-1-yl]methanone Openeye Name: [4-(azepan-1-ylmethyl)phenyl]-(4-isobutylpiperazin-1-yl)methanone CAS Name: [4-(1-azepanylmethyl)phenyl]-[4-(2-methylpropyl)-1-piperazinyl]methanone IUPAC Name: [4-(azepan-1-ylmethyl)phenyl]-[4-(2-methylpropyl)piperazin-1-yl]methanone Traditional Name: [4-(azepan-1-ylmethyl)phenyl]-(4-isobutylpiperazino)methanone Formula: C22H35N3O MolecularWeight: 357.5328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCCCCC3

Isomeric SMILES

CC(C)CN1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCCCCC3

InChI

InChI=1S/C22H35N3O/c1-19(2)17-24-13-15-25(16-14-24)22(26)21-9-7-20(8-10-21)18-23-11-5-3-4-6-12-23/h7-10,19H,3-6,11-18H2,1-2H3