2,2-dimethyl-N-[6-[4-(2-oxidanyl-3-prop-2-enoxy-propyl)-1,4-diazepan-1-yl]pyridin-3-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[6-[4-(2-oxidanyl-3-prop-2-enoxy-propyl)-1,4-diazepan-1-yl]pyridin-3-yl]propanamide Openeye Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)-1,4-diazepan-1-yl]-3-pyridyl]-2,2-dimethyl-propanamide CAS Name: N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)-1,4-diazepan-1-yl]-3-pyridinyl]-2,2-dimethylpropanamide IUPAC Name: N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)-1,4-diazepan-1-yl]pyridin-3-yl]-2,2-dimethylpropanamide Traditional Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)-1,4-diazepan-1-yl]-3-pyridyl]-2,2-dimethyl-propionamide Formula: C21H34N4O3 MolecularWeight: 390.51966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CN=C(C=C1)N2CCCN(CC2)CC(COCC=C)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=CN=C(C=C1)N2CCCN(CC2)CC(COCC=C)O

InChI

InChI=1S/C21H34N4O3/c1-5-13-28-16-18(26)15-24-9-6-10-25(12-11-24)19-8-7-17(14-22-19)23-20(27)21(2,3)4/h5,7-8,14,18,26H,1,6,9-13,15-16H2,2-4H3,(H,23,27)