4-ethanoyl-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-ethanoyl-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-acetyl-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-acetyl-N-[3-methyl-4-(1-pyrrolidinyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-acetyl-N-(3-methyl-4-pyrrolidin-1-ylphenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-acetyl-N-(3-methyl-4-pyrrolidino-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CN(C3=CC=CC=C3O2)C(=O)C)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CN(C3=CC=CC=C3O2)C(=O)C)N4CCCC4

InChI

InChI=1S/C22H25N3O3/c1-15-13-17(9-10-18(15)24-11-5-6-12-24)23-22(27)21-14-25(16(2)26)19-7-3-4-8-20(19)28-21/h3-4,7-10,13,21H,5-6,11-12,14H2,1-2H3,(H,23,27)