2-acetamidoethyl-[(1S)-1-(3-nitrophenyl)butyl]azanium

Systemtic Name: 2-acetamidoethyl-[(1S)-1-(3-nitrophenyl)butyl]azanium Openeye Name: 2-acetamidoethyl-[(1S)-1-(3-nitrophenyl)butyl]ammonium CAS Name: 2-acetamidoethyl-[(1S)-1-(3-nitrophenyl)butyl]ammonium IUPAC Name: 2-acetamidoethyl-[(1S)-1-(3-nitrophenyl)butyl]azanium Traditional Name: 2-acetamidoethyl-[(1S)-1-(3-nitrophenyl)butyl]ammonium Formula: C14H22N3O3+ MolecularWeight: 280.34278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=CC=C1)[N+](=O)[O-])[NH2+]CCNC(=O)C

Isomeric SMILES

CCC[C@@H](C1=CC(=CC=C1)[N+](=O)[O-])[NH2+]CCNC(=O)C

InChI

InChI=1S/C14H21N3O3/c1-3-5-14(16-9-8-15-11(2)18)12-6-4-7-13(10-12)17(19)20/h4,6-7,10,14,16H,3,5,8-9H2,1-2H3,(H,15,18)/p+1/t14-/m0/s1