7-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]heptanoic acid

Systemtic Name: 7-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]heptanoic acid Openeye Name: 7-[(4-isopropylphenyl)methyl-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]heptanoic acid IUPAC Name: 7-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]heptanoic acid Traditional Name: 7-[(4-isopropylbenzyl)-mesyl-amino]enanthic acid Formula: C18H29NO4S MolecularWeight: 355.49216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(CCCCCCC(=O)O)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(CCCCCCC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C18H29NO4S/c1-15(2)17-11-9-16(10-12-17)14-19(24(3,22)23)13-7-5-4-6-8-18(20)21/h9-12,15H,4-8,13-14H2,1-3H3,(H,20,21)