3-azanyl-2,2,3-trimethyl-5-(2-methylpropylamino)-6-oxidanyl-4-oxidanylidene-5-(phenylmethyl)heptanoic acid

Systemtic Name: 3-azanyl-2,2,3-trimethyl-5-(2-methylpropylamino)-6-oxidanyl-4-oxidanylidene-5-(phenylmethyl)heptanoic acid Openeye Name: 3-amino-5-benzyl-6-hydroxy-5-(isobutylamino)-2,2,3-trimethyl-4-oxo-heptanoic acid CAS Name: 3-amino-6-hydroxy-2,2,3-trimethyl-5-(2-methylpropylamino)-4-oxo-5-(phenylmethyl)heptanoic acid IUPAC Name: 3-amino-5-benzyl-6-hydroxy-2,2,3-trimethyl-5-(2-methylpropylamino)-4-oxoheptanoic acid Traditional Name: 3-amino-5-benzyl-6-hydroxy-5-(isobutylamino)-4-keto-2,2,3-trimethyl-enanthic acid Formula: C21H34N2O4 MolecularWeight: 378.50566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(CC1=CC=CC=C1)(C(C)O)C(=O)C(C)(C(C)(C)C(=O)O)N

Isomeric SMILES

CC(C)CNC(CC1=CC=CC=C1)(C(C)O)C(=O)C(C)(C(C)(C)C(=O)O)N

InChI

InChI=1S/C21H34N2O4/c1-14(2)13-23-21(15(3)24,12-16-10-8-7-9-11-16)17(25)20(6,22)19(4,5)18(26)27/h7-11,14-15,23-24H,12-13,22H2,1-6H3,(H,26,27)