(2S)-2-azanyl-4-(phenethylamino)-1-piperidin-1-yl-butan-1-one

Systemtic Name: (2S)-2-azanyl-4-(phenethylamino)-1-piperidin-1-yl-butan-1-one Openeye Name: (2S)-2-amino-4-(phenethylamino)-1-(1-piperidyl)butan-1-one CAS Name: (2S)-2-amino-4-(phenethylamino)-1-(1-piperidinyl)-1-butanone IUPAC Name: (2S)-2-amino-4-(phenethylamino)-1-piperidin-1-ylbutan-1-one Traditional Name: (2S)-2-amino-4-(phenethylamino)-1-piperidino-butan-1-one Formula: C17H27N3O MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CCNCCC2=CC=CC=C2)N

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H](CCNCCC2=CC=CC=C2)N

InChI

InChI=1S/C17H27N3O/c18-16(17(21)20-13-5-2-6-14-20)10-12-19-11-9-15-7-3-1-4-8-15/h1,3-4,7-8,16,19H,2,5-6,9-14,18H2/t16-/m0/s1