4-[2-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-1H-indol-3-yl]butylamine Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)OC)C(=C(N2)C3=CC4=C(C=C3)OCO4)CCCCN

Isomeric SMILES

CC1=C2C(=CC(=C1)OC)C(=C(N2)C3=CC4=C(C=C3)OCO4)CCCCN

InChI

InChI=1S/C21H24N2O3/c1-13-9-15(24-2)11-17-16(5-3-4-8-22)21(23-20(13)17)14-6-7-18-19(10-14)26-12-25-18/h6-7,9-11,23H,3-5,8,12,22H2,1-2H3