methyl 4-[[2-acetamido-6-(phenylmethoxycarbonylamino)hexanoyl]amino]-2-(3-phenylmethoxyphenyl)benzoate

Systemtic Name: methyl 4-[[2-acetamido-6-(phenylmethoxycarbonylamino)hexanoyl]amino]-2-(3-phenylmethoxyphenyl)benzoate Openeye Name: methyl 4-[[2-acetamido-6-(benzyloxycarbonylamino)hexanoyl]amino]-2-(3-benzyloxyphenyl)benzoate CAS Name: 4-[[2-acetamido-1-oxo-6-(phenylmethoxycarbonylamino)hexyl]amino]-2-(3-phenylmethoxyphenyl)benzoic acid methyl ester IUPAC Name: methyl 4-[[2-acetamido-6-(phenylmethoxycarbonylamino)hexanoyl]amino]-2-(3-phenylmethoxyphenyl)benzoate Traditional Name: 4-[[2-acetamido-6-(benzyloxycarbonylamino)hexanoyl]amino]-2-(3-benzoxyphenyl)benzoic acid methyl ester Formula: C37H39N3O7 MolecularWeight: 637.72146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)C(=O)OC)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)C(=O)OC)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C37H39N3O7/c1-26(41)39-34(18-9-10-21-38-37(44)47-25-28-14-7-4-8-15-28)35(42)40-30-19-20-32(36(43)45-2)33(23-30)29-16-11-17-31(22-29)46-24-27-12-5-3-6-13-27/h3-8,11-17,19-20,22-23,34H,9-10,18,21,24-25H2,1-2H3,(H,38,44)(H,39,41)(H,40,42)