2-[[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazole-4-carboxylic acid

Systemtic Name: 2-[[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazole-4-carboxylic acid Openeye Name: 2-[[1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-piperidyl]amino]-1,3-benzoxazole-4-carboxylic acid CAS Name: 2-[[1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-piperidinyl]amino]-1,3-benzoxazole-4-carboxylic acid IUPAC Name: 2-[[1-[(3-ethoxy-4-methoxyphenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazole-4-carboxylic acid Traditional Name: 2-[[1-(3-ethoxy-4-methoxy-benzyl)-4-piperidyl]amino]-1,3-benzoxazole-4-carboxylic acid Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=NC4=C(C=CC=C4O3)C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=NC4=C(C=CC=C4O3)C(=O)O)OC

InChI

InChI=1S/C23H27N3O5/c1-3-30-20-13-15(7-8-18(20)29-2)14-26-11-9-16(10-12-26)24-23-25-21-17(22(27)28)5-4-6-19(21)31-23/h4-8,13,16H,3,9-12,14H2,1-2H3,(H,24,25)(H,27,28)