1-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-7-methoxy-2-(1-phenylethyl)-1H-isoquinoline

Systemtic Name: 1-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-7-methoxy-2-(1-phenylethyl)-1H-isoquinoline Openeye Name: 1-[(3,5-dichloro-4-pyridyl)methyl]-7-methoxy-2-(1-phenylethyl)-1H-isoquinoline CAS Name: 1-[(3,5-dichloro-4-pyridinyl)methyl]-7-methoxy-2-(1-phenylethyl)-1H-isoquinoline IUPAC Name: 1-[(3,5-dichloropyridin-4-yl)methyl]-7-methoxy-2-(1-phenylethyl)-1H-isoquinoline Traditional Name: 1-[(3,5-dichloro-4-pyridyl)methyl]-7-methoxy-2-(1-phenylethyl)-1H-isoquinoline Formula: C24H22Cl2N2O MolecularWeight: 425.35028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C=CC3=C(C2CC4=C(C=NC=C4Cl)Cl)C=C(C=C3)OC

Isomeric SMILES

CC(C1=CC=CC=C1)N2C=CC3=C(C2CC4=C(C=NC=C4Cl)Cl)C=C(C=C3)OC

InChI

InChI=1S/C24H22Cl2N2O/c1-16(17-6-4-3-5-7-17)28-11-10-18-8-9-19(29-2)12-20(18)24(28)13-21-22(25)14-27-15-23(21)26/h3-12,14-16,24H,13H2,1-2H3