7-chloranyl-5-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole benzoate

Systemtic Name: 7-chloranyl-5-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole benzoate Openeye Name: 7-chloro-5-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole benzoate CAS Name: 7-chloro-5-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole benzoate IUPAC Name: 7-chloro-5-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole benzoate Traditional Name: 7-chloro-5-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole benzoate Formula: C22H22ClN2O2- MolecularWeight: 381.87528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CN2)C3=CCN(CC3)C)Cl.C1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CN2)C3=CCN(CC3)C)Cl.C1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C15H17ClN2.C7H6O2/c1-10-7-12-13(9-17-15(12)14(16)8-10)11-3-5-18(2)6-4-11;8-7(9)6-4-2-1-3-5-6/h3,7-9,17H,4-6H2,1-2H3;1-5H,(H,8,9)/p-1