N-(4-aminocarbonylphenyl)-4-(azepan-1-ylmethyl)benzamide

Systemtic Name: N-(4-aminocarbonylphenyl)-4-(azepan-1-ylmethyl)benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-(4-carbamoylphenyl)benzamide CAS Name: 4-(1-azepanylmethyl)-N-(4-carbamoylphenyl)benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-(4-carbamoylphenyl)benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-(4-carbamoylphenyl)benzamide Formula: C21H25N3O2 MolecularWeight: 351.4421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H25N3O2/c22-20(25)17-9-11-19(12-10-17)23-21(26)18-7-5-16(6-8-18)15-24-13-3-1-2-4-14-24/h5-12H,1-4,13-15H2,(H2,22,25)(H,23,26)