2-[[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)butylidene]amino]butan-1-ol

Systemtic Name: 2-[[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)butylidene]amino]butan-1-ol Openeye Name: 2-[[(2E)-2-(1,3-benzodioxol-5-ylmethylene)butylidene]amino]butan-1-ol CAS Name: 2-[[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)butylidene]amino]-1-butanol IUPAC Name: 2-[[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)butylidene]amino]butan-1-ol Traditional Name: 2-[[(E)-3-(1,3-benzodioxol-5-yl)-2-ethyl-prop-2-enylidene]amino]butan-1-ol Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N=CC(=CC1=CC2=C(C=C1)OCO2)CC

Isomeric SMILES

CCC(CO)N=C/C(=C/C1=CC2=C(C=C1)OCO2)/CC

InChI

InChI=1S/C16H21NO3/c1-3-12(9-17-14(4-2)10-18)7-13-5-6-15-16(8-13)20-11-19-15/h5-9,14,18H,3-4,10-11H2,1-2H3/b12-7+,17-9?