2-[[phenyl-[2-(pyridin-2-ylcarbonylamino)phenyl]methylidene]amino]-2-prop-2-ynyl-pent-4-ynoic acid

Systemtic Name: 2-[[phenyl-[2-(pyridin-2-ylcarbonylamino)phenyl]methylidene]amino]-2-prop-2-ynyl-pent-4-ynoic acid Openeye Name: 2-[[phenyl-[2-(pyridine-2-carbonylamino)phenyl]methylene]amino]-2-prop-2-ynyl-pent-4-ynoic acid CAS Name: 2-[[[2-[[oxo(2-pyridinyl)methyl]amino]phenyl]-phenylmethylidene]amino]-2-prop-2-ynyl-4-pentynoic acid IUPAC Name: 2-[[phenyl-[2-(pyridine-2-carbonylamino)phenyl]methylidene]amino]-2-prop-2-ynylpent-4-ynoic acid Traditional Name: 2-[[phenyl-(2-picolinamidophenyl)methylene]amino]-2-propargyl-pent-4-ynoic acid Formula: C27H21N3O3 MolecularWeight: 435.47394

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(CC#C)(C(=O)O)N=C(C1=CC=CC=C1)C2=CC=CC=C2NC(=O)C3=CC=CC=N3

Isomeric SMILES

C#CCC(CC#C)(C(=O)O)N=C(C1=CC=CC=C1)C2=CC=CC=C2NC(=O)C3=CC=CC=N3

InChI

InChI=1S/C27H21N3O3/c1-3-17-27(18-4-2,26(32)33)30-24(20-12-6-5-7-13-20)21-14-8-9-15-22(21)29-25(31)23-16-10-11-19-28-23/h1-2,5-16,19H,17-18H2,(H,29,31)(H,32,33)