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

Systemtic Name: 2-(butoxycarbonylamino)-2-[(4-dimethylaminophenyl)methylamino]-3-oxidanyl-5-phenyl-pentanoic acid Openeye Name: 2-(butoxycarbonylamino)-2-[(4-dimethylaminophenyl)methylamino]-3-hydroxy-5-phenyl-pentanoic acid CAS Name: 2-[[butoxy(oxo)methyl]amino]-2-[(4-dimethylaminophenyl)methylamino]-3-hydroxy-5-phenylpentanoic acid IUPAC Name: 2-(butoxycarbonylamino)-2-[(4-dimethylaminophenyl)methylamino]-3-hydroxy-5-phenylpentanoic acid Traditional Name: 2-(butoxycarbonylamino)-2-[[4-(dimethylamino)benzyl]amino]-3-hydroxy-5-phenyl-valeric acid Formula: C25H35N3O5 MolecularWeight: 457.5625

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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)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O5/c1-4-5-17-33-24(32)27-25(23(30)31,22(29)16-13-19-9-7-6-8-10-19)26-18-20-11-14-21(15-12-20)28(2)3/h6-12,14-15,22,26,29H,4-5,13,16-18H2,1-3H3,(H,27,32)(H,30,31)