4-[(2-ethoxy-2-oxidanylidene-ethyl)-pentyl-amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-ethoxy-2-oxidanylidene-ethyl)-pentyl-amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-[(2-ethoxy-2-oxo-ethyl)-pentyl-amino]-3-(2-naphthylsulfonylamino)-4-oxo-butanoic acid CAS Name: 4-[(2-ethoxy-2-oxoethyl)-pentylamino]-3-(2-naphthalenylsulfonylamino)-4-oxobutanoic acid IUPAC Name: 4-[(2-ethoxy-2-oxoethyl)-pentylamino]-3-(naphthalen-2-ylsulfonylamino)-4-oxobutanoic acid Traditional Name: 4-[amyl-(2-ethoxy-2-keto-ethyl)amino]-4-keto-3-(2-naphthylsulfonylamino)butyric acid Formula: C23H30N2O7S MolecularWeight: 478.5585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)OCC)C(=O)C(CC(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCCN(CC(=O)OCC)C(=O)C(CC(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C23H30N2O7S/c1-3-5-8-13-25(16-22(28)32-4-2)23(29)20(15-21(26)27)24-33(30,31)19-12-11-17-9-6-7-10-18(17)14-19/h6-7,9-12,14,20,24H,3-5,8,13,15-16H2,1-2H3,(H,26,27)