[3-chloranyl-5-methoxy-4-(3-methylbutoxy)phenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [3-chloranyl-5-methoxy-4-(3-methylbutoxy)phenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (3-chloro-4-isopentyloxy-5-methoxy-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [3-chloro-5-methoxy-4-(3-methylbutoxy)phenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [3-chloro-5-methoxy-4-(3-methylbutoxy)phenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (3-chloro-4-isoamoxy-5-methoxy-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C22H26ClNO3 MolecularWeight: 387.89974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)N2CCC3=CC=CC=C3C2)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)N2CCC3=CC=CC=C3C2)OC

InChI

InChI=1S/C22H26ClNO3/c1-15(2)9-11-27-21-19(23)12-18(13-20(21)26-3)22(25)24-10-8-16-6-4-5-7-17(16)14-24/h4-7,12-13,15H,8-11,14H2,1-3H3