2-ethyl-5-methoxy-3-[(4-nitrophenoxy)methyl]-1-(phenylmethyl)indole-4,7-dione

Systemtic Name: 2-ethyl-5-methoxy-3-[(4-nitrophenoxy)methyl]-1-(phenylmethyl)indole-4,7-dione Openeye Name: 1-benzyl-2-ethyl-5-methoxy-3-[(4-nitrophenoxy)methyl]indole-4,7-dione CAS Name: 2-ethyl-5-methoxy-3-[(4-nitrophenoxy)methyl]-1-(phenylmethyl)indole-4,7-dione IUPAC Name: 1-benzyl-2-ethyl-5-methoxy-3-[(4-nitrophenoxy)methyl]indole-4,7-dione Traditional Name: 1-benzyl-2-ethyl-5-methoxy-3-[(4-nitrophenoxy)methyl]indole-4,7-quinone Formula: C25H22N2O6 MolecularWeight: 446.45198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C(=O)C=C(C2=O)OC)COC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C(=O)C=C(C2=O)OC)COC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H22N2O6/c1-3-20-19(15-33-18-11-9-17(10-12-18)27(30)31)23-24(21(28)13-22(32-2)25(23)29)26(20)14-16-7-5-4-6-8-16/h4-13H,3,14-15H2,1-2H3