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

Systemtic Name: 1-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 1-(4-isopentyloxy-3-methoxy-phenyl)-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 1-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-(2-pyridin-1-iumyl)-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 1-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 1-(4-isoamoxy-3-methoxy-phenyl)-2-pyridin-1-ium-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C28H27N2O5+ MolecularWeight: 471.52438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H26N2O5/c1-17(2)13-15-34-21-12-11-18(16-22(21)33-3)25-24-26(31)19-8-4-5-9-20(19)35-27(24)28(32)30(25)23-10-6-7-14-29-23/h4-12,14,16-17,25H,13,15H2,1-3H3/p+1