1-[3-[(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)methyl]azepan-1-yl]-3-(2-methoxynaphthalen-1-yl)propan-2-ol

Systemtic Name: 1-[3-[(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)methyl]azepan-1-yl]-3-(2-methoxynaphthalen-1-yl)propan-2-ol Openeye Name: 1-[3-[(5,6-dimethoxyisoindolin-2-yl)methyl]azepan-1-yl]-3-(2-methoxy-1-naphthyl)propan-2-ol CAS Name: 1-[3-[(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)methyl]-1-azepanyl]-3-(2-methoxy-1-naphthalenyl)-2-propanol IUPAC Name: 1-[3-[(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)methyl]azepan-1-yl]-3-(2-methoxynaphthalen-1-yl)propan-2-ol Traditional Name: 1-[3-[(5,6-dimethoxyisoindolin-2-yl)methyl]azepan-1-yl]-3-(2-methoxy-1-naphthyl)propan-2-ol Formula: C31H40N2O4 MolecularWeight: 504.6603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)CC(CN3CCCCC(C3)CN4CC5=CC(=C(C=C5C4)OC)OC)O

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)CC(CN3CCCCC(C3)CN4CC5=CC(=C(C=C5C4)OC)OC)O

InChI

InChI=1S/C31H40N2O4/c1-35-29-12-11-23-9-4-5-10-27(23)28(29)16-26(34)21-32-13-7-6-8-22(17-32)18-33-19-24-14-30(36-2)31(37-3)15-25(24)20-33/h4-5,9-12,14-15,22,26,34H,6-8,13,16-21H2,1-3H3