2-[[[(4-cyanophenyl)amino]-(3-methylbutylamino)methylidene]amino]ethanoic acid

Systemtic Name: 2-[[[(4-cyanophenyl)amino]-(3-methylbutylamino)methylidene]amino]ethanoic acid Openeye Name: 2-[[(4-cyanoanilino)-(isopentylamino)methylene]amino]acetic acid CAS Name: 2-[[(4-cyanoanilino)-(3-methylbutylamino)methylidene]amino]acetic acid IUPAC Name: 2-[[(4-cyanoanilino)-(3-methylbutylamino)methylidene]amino]acetic acid Traditional Name: 2-[[(4-cyanoanilino)-(isoamylamino)methylene]amino]acetic acid Formula: C15H20N4O2 MolecularWeight: 288.3449

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=NCC(=O)O)NC1=CC=C(C=C1)C#N

Isomeric SMILES

CC(C)CCNC(=NCC(=O)O)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C15H20N4O2/c1-11(2)7-8-17-15(18-10-14(20)21)19-13-5-3-12(9-16)4-6-13/h3-6,11H,7-8,10H2,1-2H3,(H,20,21)(H2,17,18,19)