[4-[2-(cyclopentylamino)butanoyl]-2-(4-methylphenyl)carbonyloxy-phenyl] 4-methylbenzoate

Systemtic Name: [4-[2-(cyclopentylamino)butanoyl]-2-(4-methylphenyl)carbonyloxy-phenyl] 4-methylbenzoate Openeye Name: [4-[2-(cyclopentylamino)butanoyl]-2-(4-methylbenzoyl)oxy-phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[2-(cyclopentylamino)-1-oxobutyl]-2-[(4-methylphenyl)-oxomethoxy]phenyl] ester IUPAC Name: [4-[2-(cyclopentylamino)butanoyl]-2-(4-methylbenzoyl)oxyphenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[2-(cyclopentylamino)butanoyl]-2-p-toluoyloxy-phenyl] ester Formula: C31H33NO5 MolecularWeight: 499.59742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C)NC4CCCC4

Isomeric SMILES

CCC(C(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C)NC4CCCC4

InChI

InChI=1S/C31H33NO5/c1-4-26(32-25-7-5-6-8-25)29(33)24-17-18-27(36-30(34)22-13-9-20(2)10-14-22)28(19-24)37-31(35)23-15-11-21(3)12-16-23/h9-19,25-26,32H,4-8H2,1-3H3