2-[3-methoxypropyl(pentyl)carbamoyl]-5-naphthalen-2-ylsulfonyl-pentanoic acid

Systemtic Name: 2-[3-methoxypropyl(pentyl)carbamoyl]-5-naphthalen-2-ylsulfonyl-pentanoic acid Openeye Name: 2-[3-methoxypropyl(pentyl)carbamoyl]-5-(2-naphthylsulfonyl)pentanoic acid CAS Name: 2-[[3-methoxypropyl(pentyl)amino]-oxomethyl]-5-(2-naphthalenylsulfonyl)pentanoic acid IUPAC Name: 2-[3-methoxypropyl(pentyl)carbamoyl]-5-naphthalen-2-ylsulfonylpentanoic acid Traditional Name: 2-[amyl(3-methoxypropyl)carbamoyl]-5-(2-naphthylsulfonyl)valeric acid Formula: C25H35NO6S MolecularWeight: 477.6135

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO6S/c1-3-4-7-15-26(16-9-17-32-2)24(27)23(25(28)29)12-8-18-33(30,31)22-14-13-20-10-5-6-11-21(20)19-22/h5-6,10-11,13-14,19,23H,3-4,7-9,12,15-18H2,1-2H3,(H,28,29)