4-(1,3-benzodioxol-5-yl)-N-(3,4-dihydro-2H-chromen-4-ylmethyl)butan-2-amine

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-N-(3,4-dihydro-2H-chromen-4-ylmethyl)butan-2-amine Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-(chroman-4-ylmethyl)butan-2-amine CAS Name: 4-(1,3-benzodioxol-5-yl)-N-(3,4-dihydro-2H-1-benzopyran-4-ylmethyl)-2-butanamine IUPAC Name: 4-(1,3-benzodioxol-5-yl)-N-(3,4-dihydro-2H-chromen-4-ylmethyl)butan-2-amine Traditional Name: [3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-(chroman-4-ylmethyl)amine Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)NCC3CCOC4=CC=CC=C34

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)NCC3CCOC4=CC=CC=C34

InChI

InChI=1S/C21H25NO3/c1-15(6-7-16-8-9-20-21(12-16)25-14-24-20)22-13-17-10-11-23-19-5-3-2-4-18(17)19/h2-5,8-9,12,15,17,22H,6-7,10-11,13-14H2,1H3