methyl (2R)-4-methyl-2-[[5-[(3-nitrophenyl)amino]-5-oxidanylidene-pentanoyl]amino]pentanoate

Systemtic Name: methyl (2R)-4-methyl-2-[[5-[(3-nitrophenyl)amino]-5-oxidanylidene-pentanoyl]amino]pentanoate Openeye Name: methyl (2R)-4-methyl-2-[[5-(3-nitroanilino)-5-oxo-pentanoyl]amino]pentanoate CAS Name: (2R)-4-methyl-2-[[5-(3-nitroanilino)-1,5-dioxopentyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R)-4-methyl-2-[[5-(3-nitroanilino)-5-oxopentanoyl]amino]pentanoate Traditional Name: (2R)-2-[[5-keto-5-(3-nitroanilino)pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C18H25N3O6 MolecularWeight: 379.4076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O6/c1-12(2)10-15(18(24)27-3)20-17(23)9-5-8-16(22)19-13-6-4-7-14(11-13)21(25)26/h4,6-7,11-12,15H,5,8-10H2,1-3H3,(H,19,22)(H,20,23)/t15-/m1/s1