2-[(6-azanyl-7-oxidanylidene-7-phenylmethoxy-heptanoyl)amino]-3-(4-methoxyphenyl)propanoic acid

Systemtic Name: 2-[(6-azanyl-7-oxidanylidene-7-phenylmethoxy-heptanoyl)amino]-3-(4-methoxyphenyl)propanoic acid Openeye Name: 2-[(6-amino-7-benzyloxy-7-oxo-heptanoyl)amino]-3-(4-methoxyphenyl)propanoic acid CAS Name: 2-[(6-amino-1,7-dioxo-7-phenylmethoxyheptyl)amino]-3-(4-methoxyphenyl)propanoic acid IUPAC Name: 2-[(6-amino-7-oxo-7-phenylmethoxyheptanoyl)amino]-3-(4-methoxyphenyl)propanoic acid Traditional Name: 2-[(6-amino-7-benzoxy-7-keto-heptanoyl)amino]-3-(4-methoxyphenyl)propionic acid Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCCCC(C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCCCC(C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C24H30N2O6/c1-31-19-13-11-17(12-14-19)15-21(23(28)29)26-22(27)10-6-5-9-20(25)24(30)32-16-18-7-3-2-4-8-18/h2-4,7-8,11-14,20-21H,5-6,9-10,15-16,25H2,1H3,(H,26,27)(H,28,29)