3-[[(3Z)-3-(6-chloranyl-1H-pyridin-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]amino]-4-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[(3Z)-3-(6-chloranyl-1H-pyridin-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]amino]-4-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-[[(3Z)-3-(6-chloro-1H-pyridin-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]amino]-4-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]cyclobut-3-ene-1,2-dione CAS Name: 3-[[(3Z)-3-(6-chloro-1H-pyridin-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]amino]-4-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[(3Z)-3-(6-chloro-1H-pyridin-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]amino]-4-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-[[(3Z)-3-(6-chloro-1H-pyridin-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]amino]-4-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]cyclobut-3-ene-1,2-quinone Formula: C23H18ClN3O4 MolecularWeight: 435.85972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)O)NC2=C(C(=O)C2=O)NC3=CC(=C4C=CC=C(N4)Cl)C(=O)C=C3

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)O)NC2=C(C(=O)C2=O)NC3=C/C(=C/4\C=CC=C(N4)Cl)/C(=O)C=C3

InChI

InChI=1S/C23H18ClN3O4/c1-12(13-4-2-5-15(28)10-13)25-20-21(23(31)22(20)30)26-14-8-9-18(29)16(11-14)17-6-3-7-19(24)27-17/h2-12,25-28H,1H3/b17-16-/t12-/m1/s1