N-butyl-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]butan-1-amine

Systemtic Name: N-butyl-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]butan-1-amine Openeye Name: N-butyl-N-[[(1S)-isochroman-1-yl]methyl]butan-1-amine CAS Name: N-butyl-N-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-1-butanamine IUPAC Name: N-butyl-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]butan-1-amine Traditional Name: dibutyl-[[(1S)-isochroman-1-yl]methyl]amine Formula: C18H29NO MolecularWeight: 275.42896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC1C2=CC=CC=C2CCO1

Isomeric SMILES

CCCCN(CCCC)C[C@@H]1C2=CC=CC=C2CCO1

InChI

InChI=1S/C18H29NO/c1-3-5-12-19(13-6-4-2)15-18-17-10-8-7-9-16(17)11-14-20-18/h7-10,18H,3-6,11-15H2,1-2H3/t18-/m1/s1