(2R)-2-[(2-nitro-5-pyrrolidin-1-yl-phenyl)amino]butan-1-ol

Systemtic Name: (2R)-2-[(2-nitro-5-pyrrolidin-1-yl-phenyl)amino]butan-1-ol Openeye Name: (2R)-2-(2-nitro-5-pyrrolidin-1-yl-anilino)butan-1-ol CAS Name: (2R)-2-[2-nitro-5-(1-pyrrolidinyl)anilino]-1-butanol IUPAC Name: (2R)-2-(2-nitro-5-pyrrolidin-1-ylanilino)butan-1-ol Traditional Name: (2R)-2-(2-nitro-5-pyrrolidino-anilino)butan-1-ol Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=C(C=CC(=C1)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](CO)NC1=C(C=CC(=C1)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O3/c1-2-11(10-18)15-13-9-12(16-7-3-4-8-16)5-6-14(13)17(19)20/h5-6,9,11,15,18H,2-4,7-8,10H2,1H3/t11-/m1/s1