1-[4-[(4-methoxyphenyl)-phenanthren-9-yl-methyl]phenoxy]-3-(2-pyrrolidin-1-ylethylamino)propan-2-ol

Systemtic Name: 1-[4-[(4-methoxyphenyl)-phenanthren-9-yl-methyl]phenoxy]-3-(2-pyrrolidin-1-ylethylamino)propan-2-ol Openeye Name: 1-[4-[(4-methoxyphenyl)-(9-phenanthryl)methyl]phenoxy]-3-(2-pyrrolidin-1-ylethylamino)propan-2-ol CAS Name: 1-[4-[(4-methoxyphenyl)-(9-phenanthrenyl)methyl]phenoxy]-3-[2-(1-pyrrolidinyl)ethylamino]-2-propanol IUPAC Name: 1-[4-[(4-methoxyphenyl)-phenanthren-9-ylmethyl]phenoxy]-3-(2-pyrrolidin-1-ylethylamino)propan-2-ol Traditional Name: 1-[4-[(4-methoxyphenyl)-(9-phenanthryl)methyl]phenoxy]-3-(2-pyrrolidinoethylamino)propan-2-ol Formula: C37H40N2O3 MolecularWeight: 560.7251

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC(CNCCN3CCCC3)O)C4=CC5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC(CNCCN3CCCC3)O)C4=CC5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C37H40N2O3/c1-41-31-16-12-27(13-17-31)37(36-24-29-8-2-3-9-33(29)34-10-4-5-11-35(34)36)28-14-18-32(19-15-28)42-26-30(40)25-38-20-23-39-21-6-7-22-39/h2-5,8-19,24,30,37-38,40H,6-7,20-23,25-26H2,1H3