N-(4-azanylcyclohepta[b]indol-7-yl)-2-phenoxy-ethanamide; 2-oxidanyl-2-phenyl-ethanoic acid

Systemtic Name: N-(4-azanylcyclohepta[b]indol-7-yl)-2-phenoxy-ethanamide; 2-oxidanyl-2-phenyl-ethanoic acid Openeye Name: N-(4-aminocyclohepta[b]indol-7-yl)-2-phenoxy-acetamide; 2-hydroxy-2-phenyl-acetic acid CAS Name: N-(4-amino-7-cyclohepta[b]indolyl)-2-phenoxyacetamide; 2-hydroxy-2-phenylacetic acid IUPAC Name: N-(4-aminocyclohepta[b]indol-7-yl)-2-phenoxyacetamide; 2-hydroxy-2-phenylacetic acid Traditional Name: N-(4-aminocyclohept[b]indol-7-yl)-2-phenoxy-acetamide; madelic acid Formula: C29H25N3O5 MolecularWeight: 495.5259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)O.C1=CC=C(C=C1)OCC(=O)NC2=CC=CC3=C4C=CC=C(C4=NC3=C2)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)O.C1=CC=C(C=C1)OCC(=O)NC2=CC=CC3=C4C=CC=C(C4=NC3=C2)N

InChI

InChI=1S/C21H17N3O2.C8H8O3/c22-18-11-5-10-17-16-9-4-6-14(12-19(16)24-21(17)18)23-20(25)13-26-15-7-2-1-3-8-15;9-7(8(10)11)6-4-2-1-3-5-6/h1-12H,13,22H2,(H,23,25);1-5,7,9H,(H,10,11)