2-[2-acetyloxyethyl(pentyl)carbamoyl]-5-naphthalen-2-ylsulfonyl-pentanoic acid

Systemtic Name: 2-[2-acetyloxyethyl(pentyl)carbamoyl]-5-naphthalen-2-ylsulfonyl-pentanoic acid Openeye Name: 2-[2-acetoxyethyl(pentyl)carbamoyl]-5-(2-naphthylsulfonyl)pentanoic acid CAS Name: 2-[[2-acetyloxyethyl(pentyl)amino]-oxomethyl]-5-(2-naphthalenylsulfonyl)pentanoic acid IUPAC Name: 2-[2-acetyloxyethyl(pentyl)carbamoyl]-5-naphthalen-2-ylsulfonylpentanoic acid Traditional Name: 2-[2-acetoxyethyl(amyl)carbamoyl]-5-(2-naphthylsulfonyl)valeric acid Formula: C25H33NO7S MolecularWeight: 491.59702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCOC(=O)C)C(=O)C(CCCS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

CCCCCN(CCOC(=O)C)C(=O)C(CCCS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C(=O)O

InChI

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