O5-tert-butyl O1-methyl (2S)-2-[(6-oxidanylnaphthalen-1-yl)carbamoylamino]pentanedioate

Systemtic Name: O5-tert-butyl O1-methyl (2S)-2-[(6-oxidanylnaphthalen-1-yl)carbamoylamino]pentanedioate Openeye Name: O5-tert-butyl O1-methyl (2S)-2-[(6-hydroxy-1-naphthyl)carbamoylamino]pentanedioate CAS Name: (2S)-2-[[[(6-hydroxy-1-naphthalenyl)amino]-oxomethyl]amino]pentanedioic acid O5-tert-butyl ester O1-methyl ester IUPAC Name: 5-O-tert-butyl 1-O-methyl (2S)-2-[(6-hydroxynaphthalen-1-yl)carbamoylamino]pentanedioate Traditional Name: (2S)-2-[(6-hydroxy-1-naphthyl)carbamoylamino]glutaric acid O5-tert-butyl ester O1-methyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC)NC(=O)NC1=CC=CC2=C1C=CC(=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](C(=O)OC)NC(=O)NC1=CC=CC2=C1C=CC(=C2)O

InChI

InChI=1S/C21H26N2O6/c1-21(2,3)29-18(25)11-10-17(19(26)28-4)23-20(27)22-16-7-5-6-13-12-14(24)8-9-15(13)16/h5-9,12,17,24H,10-11H2,1-4H3,(H2,22,23,27)/t17-/m0/s1