4-[1,3-benzodioxol-4-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-3-methyl-aniline

Systemtic Name: 4-[1,3-benzodioxol-4-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-3-methyl-aniline Openeye Name: 4-[1,3-benzodioxol-4-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-N,N-diethyl-3-methyl-aniline CAS Name: 4-[1,3-benzodioxol-4-yl-[4-(diethylamino)-2-methylphenyl]methyl]-N,N-diethyl-3-methylaniline IUPAC Name: 4-[1,3-benzodioxol-4-yl-[4-(diethylamino)-2-methylphenyl]methyl]-N,N-diethyl-3-methylaniline Traditional Name: [4-[1,3-benzodioxol-4-yl-[4-(diethylamino)-2-methyl-phenyl]methyl]-3-methyl-phenyl]-diethyl-amine Formula: C30H38N2O2 MolecularWeight: 458.63492

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C(C2=C3C(=CC=C2)OCO3)C4=C(C=C(C=C4)N(CC)CC)C)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(C2=C3C(=CC=C2)OCO3)C4=C(C=C(C=C4)N(CC)CC)C)C

InChI

InChI=1S/C30H38N2O2/c1-7-31(8-2)23-14-16-25(21(5)18-23)29(27-12-11-13-28-30(27)34-20-33-28)26-17-15-24(19-22(26)6)32(9-3)10-4/h11-19,29H,7-10,20H2,1-6H3