O1-methyl O4-(phenylmethyl) 2-azanyl-3-ethyl-3-phosphoroso-2-propan-2-yl-butanedioate

Systemtic Name: O1-methyl O4-(phenylmethyl) 2-azanyl-3-ethyl-3-phosphoroso-2-propan-2-yl-butanedioate Openeye Name: O1-benzyl O4-methyl 3-amino-2-ethyl-3-isopropyl-2-phosphoroso-butanedioate CAS Name: 2-amino-3-ethyl-3-phosphoroso-2-propan-2-ylbutanedioic acid O1-methyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-methyl 2-amino-3-ethyl-3-phosphoroso-2-propan-2-ylbutanedioate Traditional Name: 3-amino-2-ethyl-3-isopropyl-2-phosphoroso-succinic acid O1-benzyl ester O4-methyl ester Formula: C17H24NO5P MolecularWeight: 353.349921

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC1=CC=CC=C1)(C(C(C)C)(C(=O)OC)N)P=O

Isomeric SMILES

CCC(C(=O)OCC1=CC=CC=C1)(C(C(C)C)(C(=O)OC)N)P=O

InChI

InChI=1S/C17H24NO5P/c1-5-16(24-21,17(18,12(2)3)15(20)22-4)14(19)23-11-13-9-7-6-8-10-13/h6-10,12H,5,11,18H2,1-4H3