1-[3-[2-(azepan-1-yl)ethyl]phenyl]-3-methyl-urea

Systemtic Name: 1-[3-[2-(azepan-1-yl)ethyl]phenyl]-3-methyl-urea Openeye Name: 1-[3-[2-(azepan-1-yl)ethyl]phenyl]-3-methyl-urea CAS Name: 1-[3-[2-(1-azepanyl)ethyl]phenyl]-3-methylurea IUPAC Name: 1-[3-[2-(azepan-1-yl)ethyl]phenyl]-3-methylurea Traditional Name: 1-[3-[2-(azepan-1-yl)ethyl]phenyl]-3-methyl-urea Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC=CC(=C1)CCN2CCCCCC2

Isomeric SMILES

CNC(=O)NC1=CC=CC(=C1)CCN2CCCCCC2

InChI

InChI=1S/C16H25N3O/c1-17-16(20)18-15-8-6-7-14(13-15)9-12-19-10-4-2-3-5-11-19/h6-8,13H,2-5,9-12H2,1H3,(H2,17,18,20)