N4-[(2-chlorophenyl)methyl]-N1-(4-methoxyphenyl)-1,4-diazepane-1,4-dicarboxamide

Systemtic Name: N4-[(2-chlorophenyl)methyl]-N1-(4-methoxyphenyl)-1,4-diazepane-1,4-dicarboxamide Openeye Name: N4-[(2-chlorophenyl)methyl]-N1-(4-methoxyphenyl)-1,4-diazepane-1,4-dicarboxamide CAS Name: N4-[(2-chlorophenyl)methyl]-N1-(4-methoxyphenyl)-1,4-diazepane-1,4-dicarboxamide IUPAC Name: 4-N-[(2-chlorophenyl)methyl]-1-N-(4-methoxyphenyl)-1,4-diazepane-1,4-dicarboxamide Traditional Name: N'-(2-chlorobenzyl)-N-(4-methoxyphenyl)-1,4-diazepane-1,4-dicarboxamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H25ClN4O3/c1-29-18-9-7-17(8-10-18)24-21(28)26-12-4-11-25(13-14-26)20(27)23-15-16-5-2-3-6-19(16)22/h2-3,5-10H,4,11-15H2,1H3,(H,23,27)(H,24,28)