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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CCCC2=CC=CC=C2)CCN

Isomeric SMILES

C1CN(CCN(C1)C(=O)CCCC2=CC=CC=C2)CCN

InChI

InChI=1S/C17H27N3O/c18-10-13-19-11-5-12-20(15-14-19)17(21)9-4-8-16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-15,18H2