1-(3-ethoxy-4-phenylmethoxy-phenyl)-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

Systemtic Name: 1-(3-ethoxy-4-phenylmethoxy-phenyl)-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 1-(4-benzyloxy-3-ethoxy-phenyl)-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 1-(3-ethoxy-4-phenylmethoxyphenyl)-2-(2-pyridin-1-iumyl)-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 1-(3-ethoxy-4-phenylmethoxyphenyl)-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 1-(4-benzoxy-3-ethoxy-phenyl)-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C31H25N2O5+ MolecularWeight: 505.5406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C3=C(C(=O)N2C4=CC=CC=[NH+]4)OC5=CC=CC=C5C3=O)OCC6=CC=CC=C6

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C3=C(C(=O)N2C4=CC=CC=[NH+]4)OC5=CC=CC=C5C3=O)OCC6=CC=CC=C6

InChI

InChI=1S/C31H24N2O5/c1-2-36-25-18-21(15-16-24(25)37-19-20-10-4-3-5-11-20)28-27-29(34)22-12-6-7-13-23(22)38-30(27)31(35)33(28)26-14-8-9-17-32-26/h3-18,28H,2,19H2,1H3/p+1