methyl N-[2-(4-cyclohexylcarbonyl-1,4-diazepan-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]carbamate

Systemtic Name: methyl N-[2-(4-cyclohexylcarbonyl-1,4-diazepan-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]carbamate Openeye Name: methyl N-[2-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]carbamate CAS Name: N-[2-[4-[cyclohexyl(oxo)methyl]-1,4-diazepan-1-yl]-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]carbamate Traditional Name: N-[2-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]carbamic acid methyl ester Formula: C26H39N5O4 MolecularWeight: 485.61896

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=C(C=CC(=C1)C(=O)N2CCCNCC2)N3CCCN(CC3)C(=O)C4CCCCC4

Isomeric SMILES

COC(=O)NC1=C(C=CC(=C1)C(=O)N2CCCNCC2)N3CCCN(CC3)C(=O)C4CCCCC4

InChI

InChI=1S/C26H39N5O4/c1-35-26(34)28-22-19-21(25(33)30-13-5-11-27-12-16-30)9-10-23(22)29-14-6-15-31(18-17-29)24(32)20-7-3-2-4-8-20/h9-10,19-20,27H,2-8,11-18H2,1H3,(H,28,34)