2-(3-azanyl-4-methoxy-phenyl)-2-[(4-cyanophenyl)amino]ethanoic acid

Systemtic Name: 2-(3-azanyl-4-methoxy-phenyl)-2-[(4-cyanophenyl)amino]ethanoic acid Openeye Name: 2-(3-amino-4-methoxy-phenyl)-2-(4-cyanoanilino)acetic acid CAS Name: 2-(3-amino-4-methoxyphenyl)-2-(4-cyanoanilino)acetic acid IUPAC Name: 2-(3-amino-4-methoxyphenyl)-2-(4-cyanoanilino)acetic acid Traditional Name: 2-(3-amino-4-methoxy-phenyl)-2-(4-cyanoanilino)acetic acid Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)N

InChI

InChI=1S/C16H15N3O3/c1-22-14-7-4-11(8-13(14)18)15(16(20)21)19-12-5-2-10(9-17)3-6-12/h2-8,15,19H,18H2,1H3,(H,20,21)