sodium 3-[ethanoyl-[6-[(4-methylphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]amino]propanoate

Systemtic Name: sodium 3-[ethanoyl-[6-[(4-methylphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]amino]propanoate Openeye Name: sodium 3-[acetyl-[2-(p-tolylsulfonylamino)tetralin-6-yl]amino]propanoate CAS Name: sodium 3-[acetyl-[6-[(4-methylphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]amino]propanoate IUPAC Name: sodium 3-[acetyl-[6-[(4-methylphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]amino]propanoate Traditional Name: sodium 3-[acetyl-[2-(tosylamino)tetralin-6-yl]amino]propionate Formula: C22H25N2NaO5S MolecularWeight: 452.49907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CCC3=C(C2)C=CC(=C3)N(CCC(=O)[O-])C(=O)C.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2CCC3=C(C2)C=CC(=C3)N(CCC(=O)[O-])C(=O)C.[Na+]

InChI

InChI=1S/C22H26N2O5S.Na/c1-15-3-9-21(10-4-15)30(28,29)23-19-7-5-18-14-20(8-6-17(18)13-19)24(16(2)25)12-11-22(26)27;/h3-4,6,8-10,14,19,23H,5,7,11-13H2,1-2H3,(H,26,27);/q;+1/p-1