3-[6-(2-azanyl-1-methyl-benzimidazol-4-yl)oxy-2-methyl-3,4-dihydrochromen-2-yl]propanoic acid

Systemtic Name: 3-[6-(2-azanyl-1-methyl-benzimidazol-4-yl)oxy-2-methyl-3,4-dihydrochromen-2-yl]propanoic acid Openeye Name: 3-[6-(2-amino-1-methyl-benzimidazol-4-yl)oxy-2-methyl-chroman-2-yl]propanoic acid CAS Name: 3-[6-[(2-amino-1-methyl-4-benzimidazolyl)oxy]-2-methyl-3,4-dihydro-2H-1-benzopyran-2-yl]propanoic acid IUPAC Name: 3-[6-(2-amino-1-methylbenzimidazol-4-yl)oxy-2-methyl-3,4-dihydrochromen-2-yl]propanoic acid Traditional Name: 3-[6-(2-amino-1-methyl-benzimidazol-4-yl)oxy-2-methyl-chroman-2-yl]propionic acid Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(O1)C=CC(=C2)OC3=CC=CC4=C3N=C(N4C)N)CCC(=O)O

Isomeric SMILES

CC1(CCC2=C(O1)C=CC(=C2)OC3=CC=CC4=C3N=C(N4C)N)CCC(=O)O

InChI

InChI=1S/C21H23N3O4/c1-21(11-9-18(25)26)10-8-13-12-14(6-7-16(13)28-21)27-17-5-3-4-15-19(17)23-20(22)24(15)2/h3-7,12H,8-11H2,1-2H3,(H2,22,23)(H,25,26)