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

Systemtic Name: sodium (E)-2-azanyl-5-(4-methoxyphenyl)-5-(4-propan-2-ylphenyl)pent-4-enoate Openeye Name: sodium (E)-2-amino-5-(4-isopropylphenyl)-5-(4-methoxyphenyl)pent-4-enoate CAS Name: sodium (E)-2-amino-5-(4-methoxyphenyl)-5-(4-propan-2-ylphenyl)-4-pentenoate IUPAC Name: sodium (E)-2-amino-5-(4-methoxyphenyl)-5-(4-propan-2-ylphenyl)pent-4-enoate Traditional Name: sodium (E)-2-amino-5-(4-methoxyphenyl)-5-p-cumenyl-pent-4-enoate Formula: C21H24NNaO3 MolecularWeight: 361.40993

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO3.Na/c1-14(2)15-4-6-16(7-5-15)19(12-13-20(22)21(23)24)17-8-10-18(25-3)11-9-17;/h4-12,14,20H,13,22H2,1-3H3,(H,23,24);/q;+1/p-1/b19-12+;