2-[[4-[2-(2-phenylethanoylamino)ethyl]-3,4-dihydro-2H-chromen-6-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-[2-(2-phenylethanoylamino)ethyl]-3,4-dihydro-2H-chromen-6-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-[2-[(2-phenylacetyl)amino]ethyl]chromane-6-carbonyl]amino]acetic acid CAS Name: 2-[[oxo-[4-[2-[(1-oxo-2-phenylethyl)amino]ethyl]-3,4-dihydro-2H-1-benzopyran-6-yl]methyl]amino]acetic acid IUPAC Name: 2-[[4-[2-[(2-phenylacetyl)amino]ethyl]-3,4-dihydro-2H-chromene-6-carbonyl]amino]acetic acid Traditional Name: 2-[[4-[2-[(2-phenylacetyl)amino]ethyl]chroman-6-carbonyl]amino]acetic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C1CCNC(=O)CC3=CC=CC=C3)C=C(C=C2)C(=O)NCC(=O)O

Isomeric SMILES

C1COC2=C(C1CCNC(=O)CC3=CC=CC=C3)C=C(C=C2)C(=O)NCC(=O)O

InChI

InChI=1S/C22H24N2O5/c25-20(12-15-4-2-1-3-5-15)23-10-8-16-9-11-29-19-7-6-17(13-18(16)19)22(28)24-14-21(26)27/h1-7,13,16H,8-12,14H2,(H,23,25)(H,24,28)(H,26,27)