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3-[4-(azepan-1-ylmethyl)phenyl]-2-ethyl-4-(3-methylbutoxy)benzamide

3-[4-(azepan-1-ylmethyl)phenyl]-2-ethyl-4-(3-methylbutoxy)benzamide

Systemtic Name:3-[4-(azepan-1-ylmethyl)phenyl]-2-ethyl-4-(3-methylbutoxy)benzamide
Openeye Name:3-[4-(azepan-1-ylmethyl)phenyl]-2-ethyl-4-isopentyloxy-benzamide
CAS Name:3-[4-(1-azepanylmethyl)phenyl]-2-ethyl-4-(3-methylbutoxy)benzamide
IUPAC Name:3-[4-(azepan-1-ylmethyl)phenyl]-2-ethyl-4-(3-methylbutoxy)benzamide
Traditional Name:3-[4-(azepan-1-ylmethyl)phenyl]-2-ethyl-4-isoamoxy-benzamide
Formula: C27H38N2O2
MolecularWeight: 422.60282
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1C2=CC=C(C=C2)CN3CCCCCC3)OCCC(C)C)C(=O)N


Isomeric SMILES

CCC1=C(C=CC(=C1C2=CC=C(C=C2)CN3CCCCCC3)OCCC(C)C)C(=O)N


InChI

InChI=1S/C27H38N2O2/c1-4-23-24(27(28)30)13-14-25(31-18-15-20(2)3)26(23)22-11-9-21(10-12-22)19-29-16-7-5-6-8-17-29/h9-14,20H,4-8,15-19H2,1-3H3,(H2,28,30)


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