2-(3-butan-2-yl-4-phenylmethoxy-phenyl)indolizine-1-carboxylic acid

Systemtic Name: 2-(3-butan-2-yl-4-phenylmethoxy-phenyl)indolizine-1-carboxylic acid Openeye Name: 2-(4-benzyloxy-3-sec-butyl-phenyl)indolizine-1-carboxylic acid CAS Name: 2-(3-butan-2-yl-4-phenylmethoxyphenyl)-1-indolizinecarboxylic acid IUPAC Name: 2-(3-butan-2-yl-4-phenylmethoxyphenyl)indolizine-1-carboxylic acid Traditional Name: 2-(4-benzoxy-3-sec-butyl-phenyl)indolizine-1-carboxylic acid Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=CC(=C1)C2=CN3C=CC=CC3=C2C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCC(C)C1=C(C=CC(=C1)C2=CN3C=CC=CC3=C2C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H25NO3/c1-3-18(2)21-15-20(12-13-24(21)30-17-19-9-5-4-6-10-19)22-16-27-14-8-7-11-23(27)25(22)26(28)29/h4-16,18H,3,17H2,1-2H3,(H,28,29)