3-(3,3-dimethyl-1-phenyl-2-benzothiophen-1-yl)propan-1-amine; methanoic acid

Systemtic Name: 3-(3,3-dimethyl-1-phenyl-2-benzothiophen-1-yl)propan-1-amine; methanoic acid Openeye Name: 3-(3,3-dimethyl-1-phenyl-2-benzothiophen-1-yl)propan-1-amine; formic acid CAS Name: 3-(3,3-dimethyl-1-phenyl-2-benzothiophen-1-yl)-1-propanamine; formic acid IUPAC Name: 3-(3,3-dimethyl-1-phenyl-2-benzothiophen-1-yl)propan-1-amine; formic acid Traditional Name: 3-(3,3-dimethyl-1-phenyl-isobenzothiophen-1-yl)propylamine; formic acid Formula: C20H25NO2S MolecularWeight: 343.483

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(S1)(CCCN)C3=CC=CC=C3)C.C(=O)O

Isomeric SMILES

CC1(C2=CC=CC=C2C(S1)(CCCN)C3=CC=CC=C3)C.C(=O)O

InChI

InChI=1S/C19H23NS.CH2O2/c1-18(2)16-11-6-7-12-17(16)19(21-18,13-8-14-20)15-9-4-3-5-10-15;2-1-3/h3-7,9-12H,8,13-14,20H2,1-2H3;1H,(H,2,3)