4-butyl-N-(naphthalen-2-ylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-butyl-N-(naphthalen-2-ylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-butyl-N-(2-naphthylmethyl)-1,4-diazepane-1-carboxamide CAS Name: 4-butyl-N-(2-naphthalenylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-butyl-N-(naphthalen-2-ylmethyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-butyl-N-(2-naphthylmethyl)-1,4-diazepane-1-carboxamide Formula: C21H29N3O MolecularWeight: 339.47446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCN(CC1)C(=O)NCC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCN1CCCN(CC1)C(=O)NCC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H29N3O/c1-2-3-11-23-12-6-13-24(15-14-23)21(25)22-17-18-9-10-19-7-4-5-8-20(19)16-18/h4-5,7-10,16H,2-3,6,11-15,17H2,1H3,(H,22,25)