3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]propanamide

Systemtic Name: 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]propanamide Openeye Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(2-oxoazepan-1-yl)propyl]propanamide CAS Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(2-oxo-1-azepanyl)propyl]propanamide IUPAC Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(2-oxoazepan-1-yl)propyl]propanamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propionamide Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCCN3CCCCCC3=O

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCCN3CCCCCC3=O

InChI

InChI=1S/C21H29N3O4/c1-16-21(27)24(17-8-4-5-9-18(17)28-16)15-11-19(25)22-12-7-14-23-13-6-2-3-10-20(23)26/h4-5,8-9,16H,2-3,6-7,10-15H2,1H3,(H,22,25)