methyl (2S)-3-methyl-2-[[(2R)-2-[[(2S,3S)-3-methyl-2-[methyl-(4-nitrophenyl)sulfonyl-amino]pentanoyl]amino]propanoyl]amino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[(2R)-2-[[(2S,3S)-3-methyl-2-[methyl-(4-nitrophenyl)sulfonyl-amino]pentanoyl]amino]propanoyl]amino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[[(2R)-2-[[(2S,3S)-3-methyl-2-[methyl-(4-nitrophenyl)sulfonyl-amino]pentanoyl]amino]propanoyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2R)-2-[[(2S,3S)-3-methyl-2-[methyl-(4-nitrophenyl)sulfonylamino]-1-oxopentyl]amino]-1-oxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[(2R)-2-[[(2S,3S)-3-methyl-2-[methyl-(4-nitrophenyl)sulfonylamino]pentanoyl]amino]propanoyl]amino]butanoate Traditional Name: (2S)-3-methyl-2-[[(2R)-2-[[(2S,3S)-3-methyl-2-[methyl(nosyl)amino]pentanoyl]amino]propanoyl]amino]butyric acid methyl ester Formula: C22H34N4O8S MolecularWeight: 514.59236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)OC)N(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C22H34N4O8S/c1-8-14(4)19(25(6)35(32,33)17-11-9-16(10-12-17)26(30)31)21(28)23-15(5)20(27)24-18(13(2)3)22(29)34-7/h9-15,18-19H,8H2,1-7H3,(H,23,28)(H,24,27)/t14-,15+,18-,19-/m0/s1