methyl 3-(3-cyclopentyloxy-4-methoxy-phenyl)-5-[4-(2-pyrrolidin-1-ylethanoylamino)phenyl]pent-4-ynoate

Systemtic Name: methyl 3-(3-cyclopentyloxy-4-methoxy-phenyl)-5-[4-(2-pyrrolidin-1-ylethanoylamino)phenyl]pent-4-ynoate Openeye Name: methyl 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-[4-[(2-pyrrolidin-1-ylacetyl)amino]phenyl]pent-4-ynoate CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-[4-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]phenyl]-4-pentynoic acid methyl ester IUPAC Name: methyl 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-[4-[(2-pyrrolidin-1-ylacetyl)amino]phenyl]pent-4-ynoate Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-[4-[(2-pyrrolidinoacetyl)amino]phenyl]pent-4-ynoic acid methyl ester Formula: C30H36N2O5 MolecularWeight: 504.61724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)C#CC2=CC=C(C=C2)NC(=O)CN3CCCC3)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)C#CC2=CC=C(C=C2)NC(=O)CN3CCCC3)OC4CCCC4

InChI

InChI=1S/C30H36N2O5/c1-35-27-16-13-23(19-28(27)37-26-7-3-4-8-26)24(20-30(34)36-2)12-9-22-10-14-25(15-11-22)31-29(33)21-32-17-5-6-18-32/h10-11,13-16,19,24,26H,3-8,17-18,20-21H2,1-2H3,(H,31,33)