2-[bis(1-ethyl-2-methyl-indol-3-yl)methyl]-5-(dimethylamino)benzoic acid

Systemtic Name: 2-[bis(1-ethyl-2-methyl-indol-3-yl)methyl]-5-(dimethylamino)benzoic acid Openeye Name: 2-[bis(1-ethyl-2-methyl-indol-3-yl)methyl]-5-(dimethylamino)benzoic acid CAS Name: 2-[bis(1-ethyl-2-methyl-3-indolyl)methyl]-5-(dimethylamino)benzoic acid IUPAC Name: 2-[bis(1-ethyl-2-methylindol-3-yl)methyl]-5-(dimethylamino)benzoic acid Traditional Name: 2-[bis(1-ethyl-2-methyl-indol-3-yl)methyl]-5-(dimethylamino)benzoic acid Formula: C32H35N3O2 MolecularWeight: 493.6392

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C21)C(C3=C(C=C(C=C3)N(C)C)C(=O)O)C4=C(N(C5=CC=CC=C54)CC)C)C

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C21)C(C3=C(C=C(C=C3)N(C)C)C(=O)O)C4=C(N(C5=CC=CC=C54)CC)C)C

InChI

InChI=1S/C32H35N3O2/c1-7-34-20(3)29(24-13-9-11-15-27(24)34)31(23-18-17-22(33(5)6)19-26(23)32(36)37)30-21(4)35(8-2)28-16-12-10-14-25(28)30/h9-19,31H,7-8H2,1-6H3,(H,36,37)