3-[ethoxycarbonyl-[3-oxidanyl-5-(5-phenylpentan-2-yl)phenyl]amino]-2-methyl-propanoate

Systemtic Name: 3-[ethoxycarbonyl-[3-oxidanyl-5-(5-phenylpentan-2-yl)phenyl]amino]-2-methyl-propanoate Openeye Name: 3-[N-ethoxycarbonyl-3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]-2-methyl-propanoate CAS Name: 3-[N-ethoxycarbonyl-3-hydroxy-5-(5-phenylpentan-2-yl)anilino]-2-methylpropanoate IUPAC Name: 3-[N-ethoxycarbonyl-3-hydroxy-5-(5-phenylpentan-2-yl)anilino]-2-methylpropanoate Traditional Name: 3-[N-carbethoxy-3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]-2-methyl-propionate Formula: C24H30NO5- MolecularWeight: 412.4987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CC(C)C(=O)[O-])C1=CC(=CC(=C1)C(C)CCCC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)N(CC(C)C(=O)[O-])C1=CC(=CC(=C1)C(C)CCCC2=CC=CC=C2)O

InChI

InChI=1S/C24H31NO5/c1-4-30-24(29)25(16-18(3)23(27)28)21-13-20(14-22(26)15-21)17(2)9-8-12-19-10-6-5-7-11-19/h5-7,10-11,13-15,17-18,26H,4,8-9,12,16H2,1-3H3,(H,27,28)/p-1