3-[6-[(4-aminocarbonylphenyl)carbonylamino]-2-methyl-3,4-dihydrochromen-2-yl]propanoic acid

Systemtic Name: 3-[6-[(4-aminocarbonylphenyl)carbonylamino]-2-methyl-3,4-dihydrochromen-2-yl]propanoic acid Openeye Name: 3-[6-[(4-carbamoylbenzoyl)amino]-2-methyl-chroman-2-yl]propanoic acid CAS Name: 3-[6-[[(4-carbamoylphenyl)-oxomethyl]amino]-2-methyl-3,4-dihydro-2H-1-benzopyran-2-yl]propanoic acid IUPAC Name: 3-[6-[(4-carbamoylbenzoyl)amino]-2-methyl-3,4-dihydrochromen-2-yl]propanoic acid Traditional Name: 3-[6-[(4-carbamoylbenzoyl)amino]-2-methyl-chroman-2-yl]propionic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)N)CCC(=O)O

Isomeric SMILES

CC1(CCC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)N)CCC(=O)O

InChI

InChI=1S/C21H22N2O5/c1-21(11-9-18(24)25)10-8-15-12-16(6-7-17(15)28-21)23-20(27)14-4-2-13(3-5-14)19(22)26/h2-7,12H,8-11H2,1H3,(H2,22,26)(H,23,27)(H,24,25)