1-[4-(2-azanylethyl)-1,4-diazepan-1-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[4-(2-azanylethyl)-1,4-diazepan-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-2-phenyl-butan-1-one CAS Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-2-phenyl-1-butanone IUPAC Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-2-phenyl-butan-1-one Formula: C17H27N3O MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCCN(CC2)CCN

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCCN(CC2)CCN

InChI

InChI=1S/C17H27N3O/c1-2-16(15-7-4-3-5-8-15)17(21)20-11-6-10-19(12-9-18)13-14-20/h3-5,7-8,16H,2,6,9-14,18H2,1H3