[1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazol-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazol-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazol-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-[(4-chloro-3-methylphenoxy)methyl]-3-pyrazolyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-[(4-chloro-3-methylphenoxy)methyl]pyrazol-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazol-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C21H20ClN3O2/c1-15-12-18(6-7-19(15)22)27-14-25-11-9-20(23-25)21(26)24-10-8-16-4-2-3-5-17(16)13-24/h2-7,9,11-12H,8,10,13-14H2,1H3