1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2,5-dimethyl-pyrrole-3-carbaldehyde

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2,5-dimethyl-pyrrole-3-carbaldehyde Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2,5-dimethyl-pyrrole-3-carbaldehyde CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2,5-dimethyl-3-pyrrolecarboxaldehyde IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2,5-dimethylpyrrole-3-carbaldehyde Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2,5-dimethyl-pyrrole-3-carbaldehyde Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCCCO3)C)C=O

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCCCO3)C)C=O

InChI

InChI=1S/C17H19NO3/c1-12-8-15(11-19)13(2)18(12)10-14-4-5-16-17(9-14)21-7-3-6-20-16/h4-5,8-9,11H,3,6-7,10H2,1-2H3