N-methyl-3-phenyl-6-(3-phenylpropoxy)-2-(propan-2-ylcarbamoyl)inden-1-imine oxide

Systemtic Name: N-methyl-3-phenyl-6-(3-phenylpropoxy)-2-(propan-2-ylcarbamoyl)inden-1-imine oxide Openeye Name: 2-(isopropylcarbamoyl)-N-methyl-3-phenyl-6-(3-phenylpropoxy)inden-1-imine oxide CAS Name: N-methyl-2-[oxo-(propan-2-ylamino)methyl]-3-phenyl-6-(3-phenylpropoxy)-1-indenimine oxide IUPAC Name: N-methyl-3-phenyl-6-(3-phenylpropoxy)-2-(propan-2-ylcarbamoyl)inden-1-imine oxide Traditional Name: 2-(isopropylcarbamoyl)-N-methyl-3-phenyl-6-(3-phenylpropoxy)inden-1-imine oxide Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30N2O3/c1-20(2)30-29(32)27-26(22-14-8-5-9-15-22)24-17-16-23(19-25(24)28(27)31(3)33)34-18-10-13-21-11-6-4-7-12-21/h4-9,11-12,14-17,19-20H,10,13,18H2,1-3H3,(H,30,32)/b31-28+