methyl 3-[4-(cyclopentylmethoxy)-3-[6-(methylamino)naphthalen-2-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-(cyclopentylmethoxy)-3-[6-(methylamino)naphthalen-2-yl]phenyl]propanoate Openeye Name: methyl 3-[4-(cyclopentylmethoxy)-3-[6-(methylamino)-2-naphthyl]phenyl]propanoate CAS Name: 3-[4-(cyclopentylmethoxy)-3-[6-(methylamino)-2-naphthalenyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(cyclopentylmethoxy)-3-[6-(methylamino)naphthalen-2-yl]phenyl]propanoate Traditional Name: 3-[4-(cyclopentylmethoxy)-3-[6-(methylamino)-2-naphthyl]phenyl]propionic acid methyl ester Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC2=C(C=C1)C=C(C=C2)C3=C(C=CC(=C3)CCC(=O)OC)OCC4CCCC4

Isomeric SMILES

CNC1=CC2=C(C=C1)C=C(C=C2)C3=C(C=CC(=C3)CCC(=O)OC)OCC4CCCC4

InChI

InChI=1S/C27H31NO3/c1-28-24-12-11-21-16-23(10-9-22(21)17-24)25-15-19(8-14-27(29)30-2)7-13-26(25)31-18-20-5-3-4-6-20/h7,9-13,15-17,20,28H,3-6,8,14,18H2,1-2H3