2-chloranyl-N-[4-(cyclopropylmethyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[4-(cyclopropylmethyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[4-(cyclopropylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[4-(cyclopropylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[4-(cyclopropylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[4-(cyclopropylmethyl)-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl]nicotinamide Formula: C20H20ClN3O3 MolecularWeight: 385.8441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)CC4CC4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)CC4CC4

InChI

InChI=1S/C20H20ClN3O3/c1-12-20(26)24(10-13-4-5-13)11-14-9-15(6-7-17(14)27-12)23-19(25)16-3-2-8-22-18(16)21/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,25)