1-[[4-[1-(azepan-2-yl)ethoxy]-3-methoxy-phenyl]methyl]-2-(4-hydroxyphenyl)-3-methyl-indol-5-ol

Systemtic Name: 1-[[4-[1-(azepan-2-yl)ethoxy]-3-methoxy-phenyl]methyl]-2-(4-hydroxyphenyl)-3-methyl-indol-5-ol Openeye Name: 1-[[4-[1-(azepan-2-yl)ethoxy]-3-methoxy-phenyl]methyl]-2-(4-hydroxyphenyl)-3-methyl-indol-5-ol CAS Name: 1-[[4-[1-(2-azepanyl)ethoxy]-3-methoxyphenyl]methyl]-2-(4-hydroxyphenyl)-3-methyl-5-indolol IUPAC Name: 1-[[4-[1-(azepan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-(4-hydroxyphenyl)-3-methylindol-5-ol Traditional Name: 1-[4-[1-(azepan-2-yl)ethoxy]-3-methoxy-benzyl]-2-(4-hydroxyphenyl)-3-methyl-indol-5-ol Formula: C31H36N2O4 MolecularWeight: 500.62854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC(=C(C=C3)OC(C)C4CCCCCN4)OC)C5=CC=C(C=C5)O

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC(=C(C=C3)OC(C)C4CCCCCN4)OC)C5=CC=C(C=C5)O

InChI

InChI=1S/C31H36N2O4/c1-20-26-18-25(35)13-14-28(26)33(31(20)23-9-11-24(34)12-10-23)19-22-8-15-29(30(17-22)36-3)37-21(2)27-7-5-4-6-16-32-27/h8-15,17-18,21,27,32,34-35H,4-7,16,19H2,1-3H3