3-[[(E)-4-phenoxybut-2-enyl]amino]-4-(pyridin-4-ylmethyl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[(E)-4-phenoxybut-2-enyl]amino]-4-(pyridin-4-ylmethyl)cyclobut-3-ene-1,2-dione Openeye Name: 3-[[(E)-4-phenoxybut-2-enyl]amino]-4-(4-pyridylmethyl)cyclobut-3-ene-1,2-dione CAS Name: 3-[[(E)-4-phenoxybut-2-enyl]amino]-4-(pyridin-4-ylmethyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[(E)-4-phenoxybut-2-enyl]amino]-4-(pyridin-4-ylmethyl)cyclobut-3-ene-1,2-dione Traditional Name: 3-[[(E)-4-phenoxybut-2-enyl]amino]-4-(4-pyridylmethyl)cyclobut-3-ene-1,2-quinone Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC=CCNC2=C(C(=O)C2=O)CC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)OC/C=C/CNC2=C(C(=O)C2=O)CC3=CC=NC=C3

InChI

InChI=1S/C20H18N2O3/c23-19-17(14-15-8-11-21-12-9-15)18(20(19)24)22-10-4-5-13-25-16-6-2-1-3-7-16/h1-9,11-12,22H,10,13-14H2/b5-4+