4-(2-ethoxyphenyl)-N-octan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-(2-ethoxyphenyl)-N-octan-2-yl-piperazine-1-carboxamide Openeye Name: 4-(2-ethoxyphenyl)-N-(1-methylheptyl)piperazine-1-carboxamide CAS Name: 4-(2-ethoxyphenyl)-N-octan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-(2-ethoxyphenyl)-N-octan-2-ylpiperazine-1-carboxamide Traditional Name: N-(1-methylheptyl)-4-o-phenetyl-piperazine-1-carboxamide Formula: C21H35N3O2 MolecularWeight: 361.5215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)N1CCN(CC1)C2=CC=CC=C2OCC

Isomeric SMILES

CCCCCCC(C)NC(=O)N1CCN(CC1)C2=CC=CC=C2OCC

InChI

InChI=1S/C21H35N3O2/c1-4-6-7-8-11-18(3)22-21(25)24-16-14-23(15-17-24)19-12-9-10-13-20(19)26-5-2/h9-10,12-13,18H,4-8,11,14-17H2,1-3H3,(H,22,25)