4-[[6-(2-cyclopentylethanoylamino)-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[6-(2-cyclopentylethanoylamino)-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[6-[(2-cyclopentylacetyl)amino]-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[6-[(2-cyclopentyl-1-oxoethyl)amino]-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[6-[(2-cyclopentylacetyl)amino]-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[6-[(2-cyclopentylacetyl)amino]-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzoic acid Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)CN2CCOC3=C2C=C(C=C3)NC(=O)CC4CCCC4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)CN2CCOC3=C2C=C(C=C3)NC(=O)CC4CCCC4

InChI

InChI=1S/C24H28N2O5/c1-30-22-13-17(24(28)29)6-7-18(22)15-26-10-11-31-21-9-8-19(14-20(21)26)25-23(27)12-16-4-2-3-5-16/h6-9,13-14,16H,2-5,10-12,15H2,1H3,(H,25,27)(H,28,29)