butan-1-amine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid

Systemtic Name: butan-1-amine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid Openeye Name: butan-1-amine; 2,3-diisopropylnaphthalene-1-sulfonic acid CAS Name: 1-butanamine; 2,3-di(propan-2-yl)-1-naphthalenesulfonic acid IUPAC Name: butan-1-amine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid Traditional Name: butylamine; 2,3-diisopropylnaphthalene-1-sulfonic acid Formula: C20H31NO3S MolecularWeight: 365.53004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN.CC(C)C1=CC2=CC=CC=C2C(=C1C(C)C)S(=O)(=O)O

Isomeric SMILES

CCCCN.CC(C)C1=CC2=CC=CC=C2C(=C1C(C)C)S(=O)(=O)O

InChI

InChI=1S/C16H20O3S.C4H11N/c1-10(2)14-9-12-7-5-6-8-13(12)16(20(17,18)19)15(14)11(3)4;1-2-3-4-5/h5-11H,1-4H3,(H,17,18,19);2-5H2,1H3