5-[(3-ethoxy-3-oxidanylidene-propyl)-pentyl-amino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3-ethoxy-3-oxidanylidene-propyl)-pentyl-amino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(3-ethoxy-3-oxo-propyl)-pentyl-amino]-4-(2-naphthylsulfonylmethyl)-5-oxo-pentanoic acid CAS Name: 5-[(3-ethoxy-3-oxopropyl)-pentylamino]-4-(2-naphthalenylsulfonylmethyl)-5-oxopentanoic acid IUPAC Name: 5-[(3-ethoxy-3-oxopropyl)-pentylamino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxopentanoic acid Traditional Name: 5-[amyl-(3-ethoxy-3-keto-propyl)amino]-5-keto-4-(2-naphthylsulfonylmethyl)valeric acid Formula: C26H35NO7S MolecularWeight: 505.6236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35NO7S/c1-3-5-8-16-27(17-15-25(30)34-4-2)26(31)22(12-14-24(28)29)19-35(32,33)23-13-11-20-9-6-7-10-21(20)18-23/h6-7,9-11,13,18,22H,3-5,8,12,14-17,19H2,1-2H3,(H,28,29)