(2S)-2-[2-(4-methoxyphenyl)ethylcarbamoylamino]pentanedioate

Systemtic Name: (2S)-2-[2-(4-methoxyphenyl)ethylcarbamoylamino]pentanedioate Openeye Name: (2S)-2-[2-(4-methoxyphenyl)ethylcarbamoylamino]pentanedioate CAS Name: (2S)-2-[[[2-(4-methoxyphenyl)ethylamino]-oxomethyl]amino]pentanedioate IUPAC Name: (2S)-2-[2-(4-methoxyphenyl)ethylcarbamoylamino]pentanedioate Traditional Name: (2S)-2-[2-(4-methoxyphenyl)ethylcarbamoylamino]glutarate Formula: C15H18N2O6-2 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)NC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H20N2O6/c1-23-11-4-2-10(3-5-11)8-9-16-15(22)17-12(14(20)21)6-7-13(18)19/h2-5,12H,6-9H2,1H3,(H,18,19)(H,20,21)(H2,16,17,22)/p-2/t12-/m0/s1