N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-3,4,5-trimethoxy-benzamide Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCCCC2=CC=C(C=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCCCC2=CC=C(C=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C28H32N2O4/c1-32-25-17-23(18-26(33-2)27(25)34-3)28(31)29-15-6-7-20-10-12-24(13-11-20)30-16-14-21-8-4-5-9-22(21)19-30/h4-5,8-13,17-18H,6-7,14-16,19H2,1-3H3,(H,29,31)