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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO7S/c1-3-4-7-14-26(15-16-33-19(2)27)25(30)22(11-13-24(28)29)18-34(31,32)23-12-10-20-8-5-6-9-21(20)17-23/h5-6,8-10,12,17,22H,3-4,7,11,13-16,18H2,1-2H3,(H,28,29)