4-[(cyclooctylamino)methyl]-7-methoxy-N-(3-phenylpropyl)-1-benzofuran-2-carboxamide

Systemtic Name: 4-[(cyclooctylamino)methyl]-7-methoxy-N-(3-phenylpropyl)-1-benzofuran-2-carboxamide Openeye Name: 4-[(cyclooctylamino)methyl]-7-methoxy-N-(3-phenylpropyl)benzofuran-2-carboxamide CAS Name: 4-[(cyclooctylamino)methyl]-7-methoxy-N-(3-phenylpropyl)-2-benzofurancarboxamide IUPAC Name: 4-[(cyclooctylamino)methyl]-7-methoxy-N-(3-phenylpropyl)-1-benzofuran-2-carboxamide Traditional Name: 4-[(cyclooctylamino)methyl]-7-methoxy-N-(3-phenylpropyl)coumarilamide Formula: C28H36N2O3 MolecularWeight: 448.59704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)CNC3CCCCCCC3)C=C(O2)C(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)CNC3CCCCCCC3)C=C(O2)C(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C28H36N2O3/c1-32-25-17-16-22(20-30-23-14-8-3-2-4-9-15-23)24-19-26(33-27(24)25)28(31)29-18-10-13-21-11-6-5-7-12-21/h5-7,11-12,16-17,19,23,30H,2-4,8-10,13-15,18,20H2,1H3,(H,29,31)