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

Systemtic Name: 3-[(3-cyclopentyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxymethyl]benzoic acid Openeye Name: 3-[(3-cyclopentyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxymethyl]benzoic acid CAS Name: 3-[(3-cyclopentyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxymethyl]benzoic acid IUPAC Name: 3-[(3-cyclopentyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxymethyl]benzoic acid Traditional Name: 3-[(3-cyclopentyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxymethyl]benzoic acid Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC3=C(CC2)C=C(C=C3)OCC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CCC(C1)N2CCC3=C(CC2)C=C(C=C3)OCC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C23H27NO3/c25-23(26)20-5-3-4-17(14-20)16-27-22-9-8-18-10-12-24(13-11-19(18)15-22)21-6-1-2-7-21/h3-5,8-9,14-15,21H,1-2,6-7,10-13,16H2,(H,25,26)