tert-butyl (3S)-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl (3S)-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoate Openeye Name: tert-butyl (3S)-4-[(2-ethoxy-2-oxo-ethyl)amino]-3-(2-naphthylsulfonylamino)-4-oxo-butanoate CAS Name: (3S)-4-[(2-ethoxy-2-oxoethyl)amino]-3-(2-naphthalenylsulfonylamino)-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-4-[(2-ethoxy-2-oxoethyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxobutanoate Traditional Name: (3S)-4-[(2-ethoxy-2-keto-ethyl)amino]-4-keto-3-(2-naphthylsulfonylamino)butyric acid tert-butyl ester Formula: C22H28N2O7S MolecularWeight: 464.53192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(CC(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCOC(=O)CNC(=O)[C@H](CC(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C22H28N2O7S/c1-5-30-20(26)14-23-21(27)18(13-19(25)31-22(2,3)4)24-32(28,29)17-11-10-15-8-6-7-9-16(15)12-17/h6-12,18,24H,5,13-14H2,1-4H3,(H,23,27)/t18-/m0/s1