(2S)-2-methyl-N-[4-[[(2R)-2-methylbutanoyl]amino]-3-nitro-phenyl]butanamide

Systemtic Name: (2S)-2-methyl-N-[4-[[(2R)-2-methylbutanoyl]amino]-3-nitro-phenyl]butanamide Openeye Name: (2S)-2-methyl-N-[4-[[(2R)-2-methylbutanoyl]amino]-3-nitro-phenyl]butanamide CAS Name: (2S)-2-methyl-N-[4-[[(2R)-2-methyl-1-oxobutyl]amino]-3-nitrophenyl]butanamide IUPAC Name: (2S)-2-methyl-N-[4-[[(2R)-2-methylbutanoyl]amino]-3-nitrophenyl]butanamide Traditional Name: (2S)-2-methyl-N-[4-[[(2R)-2-methylbutanoyl]amino]-3-nitro-phenyl]butyramide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O4/c1-5-10(3)15(20)17-12-7-8-13(14(9-12)19(22)23)18-16(21)11(4)6-2/h7-11H,5-6H2,1-4H3,(H,17,20)(H,18,21)/t10-,11+/m0/s1