sodium (E)-2-azanyl-5-(4-phenylphenyl)-5-(4-propan-2-ylphenyl)pent-4-enoate

Systemtic Name: sodium (E)-2-azanyl-5-(4-phenylphenyl)-5-(4-propan-2-ylphenyl)pent-4-enoate Openeye Name: sodium (E)-2-amino-5-(4-isopropylphenyl)-5-(4-phenylphenyl)pent-4-enoate CAS Name: sodium (E)-2-amino-5-(4-phenylphenyl)-5-(4-propan-2-ylphenyl)-4-pentenoate IUPAC Name: sodium (E)-2-amino-5-(4-phenylphenyl)-5-(4-propan-2-ylphenyl)pent-4-enoate Traditional Name: sodium (E)-2-amino-5-p-cumenyl-5-(4-phenylphenyl)pent-4-enoate Formula: C26H26NNaO2 MolecularWeight: 407.47991

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=CCC(C(=O)[O-])N)C2=CC=C(C=C2)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C(=C\CC(C(=O)[O-])N)/C2=CC=C(C=C2)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C26H27NO2.Na/c1-18(2)19-8-12-22(13-9-19)24(16-17-25(27)26(28)29)23-14-10-21(11-15-23)20-6-4-3-5-7-20;/h3-16,18,25H,17,27H2,1-2H3,(H,28,29);/q;+1/p-1/b24-16+;