4-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]butanoate

Systemtic Name: 4-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]butanoate Openeye Name: 4-[(4-isopropylphenyl)methyl-methylsulfonyl-amino]butanoate CAS Name: 4-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]butanoate IUPAC Name: 4-[methylsulfonyl-[(4-propan-2-ylphenyl)methyl]amino]butanoate Traditional Name: 4-[(4-isopropylbenzyl)-mesyl-amino]butyrate Formula: C15H22NO4S- MolecularWeight: 312.40448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(CCCC(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(CCCC(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C15H23NO4S/c1-12(2)14-8-6-13(7-9-14)11-16(21(3,19)20)10-4-5-15(17)18/h6-9,12H,4-5,10-11H2,1-3H3,(H,17,18)/p-1