4-[(1S)-2-azanyl-1-(dibutylamino)ethyl]-2-nitro-phenol

Systemtic Name: 4-[(1S)-2-azanyl-1-(dibutylamino)ethyl]-2-nitro-phenol Openeye Name: 4-[(1S)-2-amino-1-(dibutylamino)ethyl]-2-nitro-phenol CAS Name: 4-[(1S)-2-amino-1-(dibutylamino)ethyl]-2-nitrophenol IUPAC Name: 4-[(1S)-2-amino-1-(dibutylamino)ethyl]-2-nitrophenol Traditional Name: 4-[(1S)-2-amino-1-(dibutylamino)ethyl]-2-nitro-phenol Formula: C16H27N3O3 MolecularWeight: 309.40388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(CN)C1=CC(=C(C=C1)O)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)[C@H](CN)C1=CC(=C(C=C1)O)[N+](=O)[O-]

InChI

InChI=1S/C16H27N3O3/c1-3-5-9-18(10-6-4-2)15(12-17)13-7-8-16(20)14(11-13)19(21)22/h7-8,11,15,20H,3-6,9-10,12,17H2,1-2H3/t15-/m1/s1