4-[7-(3-acetamidophenyl)heptanoylamino]-5-(4-phenylmethoxyphenyl)pentanoic acid

Systemtic Name: 4-[7-(3-acetamidophenyl)heptanoylamino]-5-(4-phenylmethoxyphenyl)pentanoic acid Openeye Name: 4-[7-(3-acetamidophenyl)heptanoylamino]-5-(4-benzyloxyphenyl)pentanoic acid CAS Name: 4-[[7-(3-acetamidophenyl)-1-oxoheptyl]amino]-5-(4-phenylmethoxyphenyl)pentanoic acid IUPAC Name: 4-[7-(3-acetamidophenyl)heptanoylamino]-5-(4-phenylmethoxyphenyl)pentanoic acid Traditional Name: 4-[7-(3-acetamidophenyl)heptanoylamino]-5-(4-benzoxyphenyl)valeric acid Formula: C33H40N2O5 MolecularWeight: 544.6811

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)CCCCCCC(=O)NC(CCC(=O)O)CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)CCCCCCC(=O)NC(CCC(=O)O)CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C33H40N2O5/c1-25(36)34-29-14-9-13-26(22-29)10-5-2-3-8-15-32(37)35-30(18-21-33(38)39)23-27-16-19-31(20-17-27)40-24-28-11-6-4-7-12-28/h4,6-7,9,11-14,16-17,19-20,22,30H,2-3,5,8,10,15,18,21,23-24H2,1H3,(H,34,36)(H,35,37)(H,38,39)