(4-aminocarbonylphenyl)methyl-methyl-[(1S)-1-(3-nitrophenyl)ethyl]azanium

Systemtic Name: (4-aminocarbonylphenyl)methyl-methyl-[(1S)-1-(3-nitrophenyl)ethyl]azanium Openeye Name: (4-carbamoylphenyl)methyl-methyl-[(1S)-1-(3-nitrophenyl)ethyl]ammonium CAS Name: (4-carbamoylphenyl)methyl-methyl-[(1S)-1-(3-nitrophenyl)ethyl]ammonium IUPAC Name: (4-carbamoylphenyl)methyl-methyl-[(1S)-1-(3-nitrophenyl)ethyl]azanium Traditional Name: (4-carbamoylbenzyl)-methyl-[(1S)-1-(3-nitrophenyl)ethyl]ammonium Formula: C17H20N3O3+ MolecularWeight: 314.359

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])[NH+](C)CC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)[N+](=O)[O-])[NH+](C)CC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C17H19N3O3/c1-12(15-4-3-5-16(10-15)20(22)23)19(2)11-13-6-8-14(9-7-13)17(18)21/h3-10,12H,11H2,1-2H3,(H2,18,21)/p+1/t12-/m0/s1