1-(7-phenyl-1,4-diazepan-1-yl)butan-1-one

Systemtic Name: 1-(7-phenyl-1,4-diazepan-1-yl)butan-1-one Openeye Name: 1-(7-phenyl-1,4-diazepan-1-yl)butan-1-one CAS Name: 1-(7-phenyl-1,4-diazepan-1-yl)-1-butanone IUPAC Name: 1-(7-phenyl-1,4-diazepan-1-yl)butan-1-one Traditional Name: 1-(7-phenyl-1,4-diazepan-1-yl)butan-1-one Formula: C15H22N2O MolecularWeight: 246.34798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCNCCC1C2=CC=CC=C2

Isomeric SMILES

CCCC(=O)N1CCNCCC1C2=CC=CC=C2

InChI

InChI=1S/C15H22N2O/c1-2-6-15(18)17-12-11-16-10-9-14(17)13-7-4-3-5-8-13/h3-5,7-8,14,16H,2,6,9-12H2,1H3