2-[1-(phenylmethyl)-2-[(phenylmethyl)amino]indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(phenylmethyl)-2-[(phenylmethyl)amino]indol-3-yl]ethanoic acid Openeye Name: 2-[1-benzyl-2-(benzylamino)indol-3-yl]acetic acid CAS Name: 2-[1-(phenylmethyl)-2-[(phenylmethyl)amino]-3-indolyl]acetic acid IUPAC Name: 2-[1-benzyl-2-(benzylamino)indol-3-yl]acetic acid Traditional Name: 2-[1-benzyl-2-(benzylamino)indol-3-yl]acetic acid Formula: C24H22N2O2 MolecularWeight: 370.44368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C3=CC=CC=C3N2CC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C3=CC=CC=C3N2CC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C24H22N2O2/c27-23(28)15-21-20-13-7-8-14-22(20)26(17-19-11-5-2-6-12-19)24(21)25-16-18-9-3-1-4-10-18/h1-14,25H,15-17H2,(H,27,28)