3-[[(1R)-1-phenylpropyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[(1R)-1-phenylpropyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[[(1R)-1-phenylpropyl]amino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[[(1R)-1-phenylpropyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[(1R)-1-phenylpropyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[[(1R)-1-phenylpropyl]amino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-quinone Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=NC=C3

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=NC=C3

InChI

InChI=1S/C18H17N3O2/c1-2-14(12-6-4-3-5-7-12)21-16-15(17(22)18(16)23)20-13-8-10-19-11-9-13/h3-11,14,21H,2H2,1H3,(H,19,20)/t14-/m1/s1