(2S)-2-[(3-nitrophenyl)amino]-N-propan-2-yl-propanamide

Systemtic Name: (2S)-2-[(3-nitrophenyl)amino]-N-propan-2-yl-propanamide Openeye Name: (2S)-N-isopropyl-2-(3-nitroanilino)propanamide CAS Name: (2S)-2-(3-nitroanilino)-N-propan-2-ylpropanamide IUPAC Name: (2S)-2-(3-nitroanilino)-N-propan-2-ylpropanamide Traditional Name: (2S)-N-isopropyl-2-(3-nitroanilino)propionamide Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)NC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O3/c1-8(2)13-12(16)9(3)14-10-5-4-6-11(7-10)15(17)18/h4-9,14H,1-3H3,(H,13,16)/t9-/m0/s1