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

Systemtic Name: 3-(2H-benzotriazol-4-ylamino)-4-[[(1R)-1-phenylpropyl]amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(2H-benzotriazol-4-ylamino)-4-[[(1R)-1-phenylpropyl]amino]cyclobut-3-ene-1,2-dione CAS Name: 3-(2H-benzotriazol-4-ylamino)-4-[[(1R)-1-phenylpropyl]amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(2H-benzotriazol-4-ylamino)-4-[[(1R)-1-phenylpropyl]amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-(2H-benzotriazol-4-ylamino)-4-[[(1R)-1-phenylpropyl]amino]cyclobut-3-ene-1,2-quinone Formula: C19H17N5O2 MolecularWeight: 347.37058

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=CC4=NNN=C43

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=CC4=NNN=C43

InChI

InChI=1S/C19H17N5O2/c1-2-12(11-7-4-3-5-8-11)20-16-17(19(26)18(16)25)21-13-9-6-10-14-15(13)23-24-22-14/h3-10,12,20-21H,2H2,1H3,(H,22,23,24)/t12-/m1/s1