2-[1-[(furan-2-ylmethylamino)-phenyl-methyl]indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(furan-2-ylmethylamino)-phenyl-methyl]indol-3-yl]ethanoic acid Openeye Name: 2-[1-[(2-furylmethylamino)-phenyl-methyl]indol-3-yl]acetic acid CAS Name: 2-[1-[(2-furanylmethylamino)-phenylmethyl]-3-indolyl]acetic acid IUPAC Name: 2-[1-[(furan-2-ylmethylamino)-phenylmethyl]indol-3-yl]acetic acid Traditional Name: 2-[1-[(2-furfurylamino)-phenyl-methyl]indol-3-yl]acetic acid Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(NCC2=CC=CO2)N3C=C(C4=CC=CC=C43)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(NCC2=CC=CO2)N3C=C(C4=CC=CC=C43)CC(=O)O

InChI

InChI=1S/C22H20N2O3/c25-21(26)13-17-15-24(20-11-5-4-10-19(17)20)22(16-7-2-1-3-8-16)23-14-18-9-6-12-27-18/h1-12,15,22-23H,13-14H2,(H,25,26)