N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(furan-2-ylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(furan-2-ylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-(2-furylmethyl)-1,4-diazepane-1-carboxamide CAS Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(2-furanylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(furan-2-ylmethyl)-1,4-diazepane-1-carboxamide Traditional Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-(2-furfuryl)-1,4-diazepane-1-carboxamide Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)N2CCCN(CC2)CC3=CC=CO3)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)N2CCCN(CC2)CC3=CC=CO3)OC4CCCC4

InChI

InChI=1S/C23H31N3O4/c1-28-21-10-9-18(16-22(21)30-19-6-2-3-7-19)24-23(27)26-12-5-11-25(13-14-26)17-20-8-4-15-29-20/h4,8-10,15-16,19H,2-3,5-7,11-14,17H2,1H3,(H,24,27)