N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methylfuran-2-yl)methyl]ethanamine

Systemtic Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methylfuran-2-yl)methyl]ethanamine Openeye Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methyl-2-furyl)methyl]ethanamine CAS Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methyl-2-furanyl)methyl]ethanamine IUPAC Name: N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methylfuran-2-yl)methyl]ethanamine Traditional Name: [3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methyl-2-furyl)methyl]-ethyl-amine Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(C1=CC2=C(C=C1)OCCCO2)C3=C(C=CO3)C

Isomeric SMILES

CCNC(C1=CC2=C(C=C1)OCCCO2)C3=C(C=CO3)C

InChI

InChI=1S/C17H21NO3/c1-3-18-16(17-12(2)7-10-21-17)13-5-6-14-15(11-13)20-9-4-8-19-14/h5-7,10-11,16,18H,3-4,8-9H2,1-2H3