4-[5-(1,5-dimethyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(1,5-dimethyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(1,5-dimethyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(1,5-dimethyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(1,5-dimethyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(1,5-dimethyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C23H24N2O2 MolecularWeight: 360.44886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C2=C1C=C(C=C2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O)C

Isomeric SMILES

CC1CCCN(C2=C1C=C(C=C2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O)C

InChI

InChI=1S/C23H24N2O2/c1-15-4-3-13-25(2)22-12-9-18(14-19(15)22)21-11-10-20(24-21)16-5-7-17(8-6-16)23(26)27/h5-12,14-15,24H,3-4,13H2,1-2H3,(H,26,27)