methyl 4-tert-butyl-3-[3-(2-methoxy-4-propanoyl-phenyl)octanoylamino]benzoate

Systemtic Name: methyl 4-tert-butyl-3-[3-(2-methoxy-4-propanoyl-phenyl)octanoylamino]benzoate Openeye Name: methyl 4-tert-butyl-3-[3-(2-methoxy-4-propanoyl-phenyl)octanoylamino]benzoate CAS Name: 4-tert-butyl-3-[[3-[2-methoxy-4-(1-oxopropyl)phenyl]-1-oxooctyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-tert-butyl-3-[3-(2-methoxy-4-propanoylphenyl)octanoylamino]benzoate Traditional Name: 4-tert-butyl-3-[3-(2-methoxy-4-propionyl-phenyl)octanoylamino]benzoic acid methyl ester Formula: C30H41NO5 MolecularWeight: 495.65024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)OC)C(C)(C)C)C2=C(C=C(C=C2)C(=O)CC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)OC)C(C)(C)C)C2=C(C=C(C=C2)C(=O)CC)OC

InChI

InChI=1S/C30H41NO5/c1-8-10-11-12-20(23-15-13-21(26(32)9-2)18-27(23)35-6)19-28(33)31-25-17-22(29(34)36-7)14-16-24(25)30(3,4)5/h13-18,20H,8-12,19H2,1-7H3,(H,31,33)