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4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]benzoic acid

4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]benzoic acid

Systemtic Name:4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]benzoic acid
Openeye Name:4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]benzoic acid
CAS Name:4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]benzoic acid
IUPAC Name:4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]benzoic acid
Traditional Name:4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]benzoic acid
Formula: C22H25NO2
MolecularWeight: 335.4394
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)CC4=CC=C(C=C4)C(=O)O


Isomeric SMILES

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)CC4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C22H25NO2/c24-22(25)19-8-4-16(5-9-19)14-17-6-7-18-10-12-23(21-2-1-3-21)13-11-20(18)15-17/h4-9,15,21H,1-3,10-14H2,(H,24,25)


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