(2S)-2-azanyl-4-[(3-nitropyridin-2-yl)amino]-1-piperidin-1-yl-butan-1-one

Systemtic Name: (2S)-2-azanyl-4-[(3-nitropyridin-2-yl)amino]-1-piperidin-1-yl-butan-1-one Openeye Name: (2S)-2-amino-4-[(3-nitro-2-pyridyl)amino]-1-(1-piperidyl)butan-1-one CAS Name: (2S)-2-amino-4-[(3-nitro-2-pyridinyl)amino]-1-(1-piperidinyl)-1-butanone IUPAC Name: (2S)-2-amino-4-[(3-nitropyridin-2-yl)amino]-1-piperidin-1-ylbutan-1-one Traditional Name: (2S)-2-amino-4-[(3-nitro-2-pyridyl)amino]-1-piperidino-butan-1-one Formula: C14H21N5O3 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CCNC2=C(C=CC=N2)[N+](=O)[O-])N

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H](CCNC2=C(C=CC=N2)[N+](=O)[O-])N

InChI

InChI=1S/C14H21N5O3/c15-11(14(20)18-9-2-1-3-10-18)6-8-17-13-12(19(21)22)5-4-7-16-13/h4-5,7,11H,1-3,6,8-10,15H2,(H,16,17)/t11-/m0/s1