5-[(2-ethoxy-2-oxidanylidene-ethyl)-pentyl-amino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2-ethoxy-2-oxidanylidene-ethyl)-pentyl-amino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(2-ethoxy-2-oxo-ethyl)-pentyl-amino]-4-(2-naphthylsulfonylmethyl)-5-oxo-pentanoic acid CAS Name: 5-[(2-ethoxy-2-oxoethyl)-pentylamino]-4-(2-naphthalenylsulfonylmethyl)-5-oxopentanoic acid IUPAC Name: 5-[(2-ethoxy-2-oxoethyl)-pentylamino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxopentanoic acid Traditional Name: 5-[amyl-(2-ethoxy-2-keto-ethyl)amino]-5-keto-4-(2-naphthylsulfonylmethyl)valeric acid Formula: C25H33NO7S MolecularWeight: 491.59702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO7S/c1-3-5-8-15-26(17-24(29)33-4-2)25(30)21(12-14-23(27)28)18-34(31,32)22-13-11-19-9-6-7-10-20(19)16-22/h6-7,9-11,13,16,21H,3-5,8,12,14-15,17-18H2,1-2H3,(H,27,28)