5-methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propyl-indole-4,7-dione

Systemtic Name: 5-methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propyl-indole-4,7-dione Openeye Name: 5-methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propyl-indole-4,7-dione CAS Name: 5-methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propylindole-4,7-dione IUPAC Name: 5-methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propylindole-4,7-dione Traditional Name: 5-methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propyl-indole-4,7-quinone Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=C1C(=O)C(=C(C2=O)OC)C)COC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=C(C2=C1C(=O)C(=C(C2=O)OC)C)COC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H22N2O6/c1-5-10-22-13(3)16(11-29-15-8-6-14(7-9-15)23(26)27)17-18(22)19(24)12(2)21(28-4)20(17)25/h6-9H,5,10-11H2,1-4H3