4-(azepan-1-ylmethyl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[(4-isopropoxy-3-methoxy-phenyl)methyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-(4-isopropoxy-3-methoxy-benzyl)benzamide Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3CCCCCC3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3CCCCCC3)OC

InChI

InChI=1S/C25H34N2O3/c1-19(2)30-23-13-10-21(16-24(23)29-3)17-26-25(28)22-11-8-20(9-12-22)18-27-14-6-4-5-7-15-27/h8-13,16,19H,4-7,14-15,17-18H2,1-3H3,(H,26,28)