2-(butoxycarbonylamino)-2-[(3,4-dimethoxyphenyl)methylamino]-3-oxidanyl-5-phenyl-pentanoic acid

Systemtic Name: 2-(butoxycarbonylamino)-2-[(3,4-dimethoxyphenyl)methylamino]-3-oxidanyl-5-phenyl-pentanoic acid Openeye Name: 2-(butoxycarbonylamino)-2-[(3,4-dimethoxyphenyl)methylamino]-3-hydroxy-5-phenyl-pentanoic acid CAS Name: 2-[[butoxy(oxo)methyl]amino]-2-[(3,4-dimethoxyphenyl)methylamino]-3-hydroxy-5-phenylpentanoic acid IUPAC Name: 2-(butoxycarbonylamino)-2-[(3,4-dimethoxyphenyl)methylamino]-3-hydroxy-5-phenylpentanoic acid Traditional Name: 2-(butoxycarbonylamino)-3-hydroxy-5-phenyl-2-(veratrylamino)valeric acid Formula: C25H34N2O7 MolecularWeight: 474.54666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(C(CCC1=CC=CC=C1)O)(C(=O)O)NCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCOC(=O)NC(C(CCC1=CC=CC=C1)O)(C(=O)O)NCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C25H34N2O7/c1-4-5-15-34-24(31)27-25(23(29)30,22(28)14-12-18-9-7-6-8-10-18)26-17-19-11-13-20(32-2)21(16-19)33-3/h6-11,13,16,22,26,28H,4-5,12,14-15,17H2,1-3H3,(H,27,31)(H,29,30)