2-ethoxycarbonyl-N-methyl-3-(4-methylphenyl)-6-(3-phenylpropoxy)inden-1-imine oxide

Systemtic Name: 2-ethoxycarbonyl-N-methyl-3-(4-methylphenyl)-6-(3-phenylpropoxy)inden-1-imine oxide Openeye Name: 2-ethoxycarbonyl-N-methyl-6-(3-phenylpropoxy)-3-(p-tolyl)inden-1-imine oxide CAS Name: 2-ethoxycarbonyl-N-methyl-3-(4-methylphenyl)-6-(3-phenylpropoxy)-1-indenimine oxide IUPAC Name: 2-ethoxycarbonyl-N-methyl-3-(4-methylphenyl)-6-(3-phenylpropoxy)inden-1-imine oxide Traditional Name: 2-carbethoxy-N-methyl-6-(3-phenylpropoxy)-3-(p-tolyl)inden-1-imine oxide Formula: C29H29NO4 MolecularWeight: 455.54486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C1=[N+](C)[O-])C=C(C=C2)OCCCC3=CC=CC=C3)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C\1=C(C2=C(/C1=[N+](/C)\[O-])C=C(C=C2)OCCCC3=CC=CC=C3)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H29NO4/c1-4-33-29(31)27-26(22-14-12-20(2)13-15-22)24-17-16-23(19-25(24)28(27)30(3)32)34-18-8-11-21-9-6-5-7-10-21/h5-7,9-10,12-17,19H,4,8,11,18H2,1-3H3/b30-28+