3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]propanamide

Systemtic Name: 3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]propanamide Openeye Name: 3-[4-(o-tolylmethyl)-1,4-diazepan-1-yl]propanamide CAS Name: 3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]propanamide IUPAC Name: 3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]propanamide Traditional Name: 3-[4-(2-methylbenzyl)-1,4-diazepan-1-yl]propionamide Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)CCC(=O)N

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)CCC(=O)N

InChI

InChI=1S/C16H25N3O/c1-14-5-2-3-6-15(14)13-19-9-4-8-18(11-12-19)10-7-16(17)20/h2-3,5-6H,4,7-13H2,1H3,(H2,17,20)