2-chloranyl-N-[2-[2-(3-methoxyphenyl)ethanoyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-[2-(3-methoxyphenyl)ethanoyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: 2-chloro-N-[2-[2-(3-methoxyphenyl)acetyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 2-chloro-N-[2-[2-(3-methoxyphenyl)-1-oxoethyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 2-chloro-N-[2-[2-(3-methoxyphenyl)acetyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 2-chloro-N-[2-[2-(3-methoxyphenyl)acetyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Formula: C25H23ClN2O3 MolecularWeight: 434.91472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C25H23ClN2O3/c1-31-21-6-4-5-17(13-21)14-24(29)28-12-11-18-9-10-20(15-19(18)16-28)27-25(30)22-7-2-3-8-23(22)26/h2-10,13,15H,11-12,14,16H2,1H3,(H,27,30)