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

Systemtic Name: 2-[[6-(cyclopentyloxycarbonylamino)-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 2-[[6-(cyclopentoxycarbonylamino)-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzoic acid CAS Name: 2-[[6-[[cyclopentyloxy(oxo)methyl]amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzoic acid IUPAC Name: 2-[[6-(cyclopentyloxycarbonylamino)-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzoic acid Traditional Name: 2-[[6-(cyclopentoxycarbonylamino)-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzoic acid Formula: C23H24N2O6 MolecularWeight: 424.44646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CN2C=COC3=C2C=C(C=C3)NC(=O)OC4CCCC4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1CN2C=COC3=C2C=C(C=C3)NC(=O)OC4CCCC4)C(=O)O

InChI

InChI=1S/C23H24N2O6/c1-29-20-8-4-7-17(22(26)27)18(20)14-25-11-12-30-21-10-9-15(13-19(21)25)24-23(28)31-16-5-2-3-6-16/h4,7-13,16H,2-3,5-6,14H2,1H3,(H,24,28)(H,26,27)