N-[6-[4-(3-methoxyphenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]cyclohexanecarboxamide

Systemtic Name: N-[6-[4-(3-methoxyphenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]cyclohexanecarboxamide Openeye Name: N-[6-[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]-3-pyridyl]cyclohexanecarboxamide CAS Name: N-[6-[4-[(3-methoxyphenyl)-oxomethyl]-1,4-diazepan-1-yl]-3-pyridinyl]cyclohexanecarboxamide IUPAC Name: N-[6-[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl]cyclohexanecarboxamide Traditional Name: N-[6-(4-m-anisoyl-1,4-diazepan-1-yl)-3-pyridyl]cyclohexanecarboxamide Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCCN(CC2)C3=NC=C(C=C3)NC(=O)C4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCCN(CC2)C3=NC=C(C=C3)NC(=O)C4CCCCC4

InChI

InChI=1S/C25H32N4O3/c1-32-22-10-5-9-20(17-22)25(31)29-14-6-13-28(15-16-29)23-12-11-21(18-26-23)27-24(30)19-7-3-2-4-8-19/h5,9-12,17-19H,2-4,6-8,13-16H2,1H3,(H,27,30)