2-[[5-methoxy-2-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoyl]-pentyl-amino]ethanoic acid

Systemtic Name: 2-[[5-methoxy-2-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoyl]-pentyl-amino]ethanoic acid Openeye Name: 2-[[5-methoxy-2-(2-naphthylsulfonylmethyl)-5-oxo-pentanoyl]-pentyl-amino]acetic acid CAS Name: 2-[[5-methoxy-2-(2-naphthalenylsulfonylmethyl)-1,5-dioxopentyl]-pentylamino]acetic acid IUPAC Name: 2-[[5-methoxy-2-(naphthalen-2-ylsulfonylmethyl)-5-oxopentanoyl]-pentylamino]acetic acid Traditional Name: 2-[amyl-[5-keto-5-methoxy-2-(2-naphthylsulfonylmethyl)pentanoyl]amino]acetic acid Formula: C24H31NO7S MolecularWeight: 477.57044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)O)C(=O)C(CCC(=O)OC)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCCN(CC(=O)O)C(=O)C(CCC(=O)OC)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C24H31NO7S/c1-3-4-7-14-25(16-22(26)27)24(29)20(11-13-23(28)32-2)17-33(30,31)21-12-10-18-8-5-6-9-19(18)15-21/h5-6,8-10,12,15,20H,3-4,7,11,13-14,16-17H2,1-2H3,(H,26,27)