methyl 4-azanyl-3-methyl-2-[[5-(4-nitrophenyl)-3-oxidanyl-pentanoyl]amino]pentanoate

Systemtic Name: methyl 4-azanyl-3-methyl-2-[[5-(4-nitrophenyl)-3-oxidanyl-pentanoyl]amino]pentanoate Openeye Name: methyl 4-amino-2-[[3-hydroxy-5-(4-nitrophenyl)pentanoyl]amino]-3-methyl-pentanoate CAS Name: 4-amino-2-[[3-hydroxy-5-(4-nitrophenyl)-1-oxopentyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 4-amino-2-[[3-hydroxy-5-(4-nitrophenyl)pentanoyl]amino]-3-methylpentanoate Traditional Name: 4-amino-2-[[3-hydroxy-5-(4-nitrophenyl)pentanoyl]amino]-3-methyl-valeric acid methyl ester Formula: C18H27N3O6 MolecularWeight: 381.42348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)N)C(C(=O)OC)NC(=O)CC(CCC1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CC(C(C)N)C(C(=O)OC)NC(=O)CC(CCC1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C18H27N3O6/c1-11(12(2)19)17(18(24)27-3)20-16(23)10-15(22)9-6-13-4-7-14(8-5-13)21(25)26/h4-5,7-8,11-12,15,17,22H,6,9-10,19H2,1-3H3,(H,20,23)