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

Systemtic Name: 1-(cycloheptylamino)-3-[4-[(4-methoxyphenyl)-phenanthren-9-yl-methyl]phenoxy]propan-2-ol Openeye Name: 1-(cycloheptylamino)-3-[4-[(4-methoxyphenyl)-(9-phenanthryl)methyl]phenoxy]propan-2-ol CAS Name: 1-(cycloheptylamino)-3-[4-[(4-methoxyphenyl)-(9-phenanthrenyl)methyl]phenoxy]-2-propanol IUPAC Name: 1-(cycloheptylamino)-3-[4-[(4-methoxyphenyl)-phenanthren-9-ylmethyl]phenoxy]propan-2-ol Traditional Name: 1-(cycloheptylamino)-3-[4-[(4-methoxyphenyl)-(9-phenanthryl)methyl]phenoxy]propan-2-ol Formula: C38H41NO3 MolecularWeight: 559.73704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC(CNC3CCCCCC3)O)C4=CC5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC(CNC3CCCCCC3)O)C4=CC5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C38H41NO3/c1-41-32-20-16-27(17-21-32)38(37-24-29-10-6-7-13-34(29)35-14-8-9-15-36(35)37)28-18-22-33(23-19-28)42-26-31(40)25-39-30-11-4-2-3-5-12-30/h6-10,13-24,30-31,38-40H,2-5,11-12,25-26H2,1H3