methyl 2-[bis[4-(dimethylamino)-2-methyl-phenyl]methyl]-5-(dimethylamino)benzoate

Systemtic Name: methyl 2-[bis[4-(dimethylamino)-2-methyl-phenyl]methyl]-5-(dimethylamino)benzoate Openeye Name: methyl 2-[bis[4-(dimethylamino)-2-methyl-phenyl]methyl]-5-(dimethylamino)benzoate CAS Name: 2-[bis[4-(dimethylamino)-2-methylphenyl]methyl]-5-(dimethylamino)benzoic acid methyl ester IUPAC Name: methyl 2-[bis[4-(dimethylamino)-2-methylphenyl]methyl]-5-(dimethylamino)benzoate Traditional Name: 2-[bis[4-(dimethylamino)-2-methyl-phenyl]methyl]-5-(dimethylamino)benzoic acid methyl ester Formula: C29H37N3O2 MolecularWeight: 459.62298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(C)C)C(C2=C(C=C(C=C2)N(C)C)C)C3=C(C=C(C=C3)N(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)N(C)C)C(C2=C(C=C(C=C2)N(C)C)C)C3=C(C=C(C=C3)N(C)C)C(=O)OC

InChI

InChI=1S/C29H37N3O2/c1-19-16-21(30(3)4)10-13-24(19)28(25-14-11-22(31(5)6)17-20(25)2)26-15-12-23(32(7)8)18-27(26)29(33)34-9/h10-18,28H,1-9H3