methyl 2-[[2-[(3-azanyl-2-oxidanyl-heptanoyl)amino]-3-oxidanyl-propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[2-[(3-azanyl-2-oxidanyl-heptanoyl)amino]-3-oxidanyl-propanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-[(3-amino-2-hydroxy-heptanoyl)amino]-3-hydroxy-propanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(3-amino-2-hydroxy-1-oxoheptyl)amino]-3-hydroxy-1-oxopropyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(3-amino-2-hydroxyheptanoyl)amino]-3-hydroxypropanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(3-amino-2-hydroxy-heptanoyl)amino]-3-hydroxy-propanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C17H33N3O6 MolecularWeight: 375.46042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)OC)O)N

Isomeric SMILES

CCCCC(C(C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)OC)O)N

InChI

InChI=1S/C17H33N3O6/c1-5-6-7-11(18)14(22)16(24)20-13(9-21)15(23)19-12(8-10(2)3)17(25)26-4/h10-14,21-22H,5-9,18H2,1-4H3,(H,19,23)(H,20,24)