1-(azepan-1-yl)-2-[(2-methyl-1,3-benzoxazol-5-yl)amino]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-[(2-methyl-1,3-benzoxazol-5-yl)amino]propan-1-one Openeye Name: 1-(azepan-1-yl)-2-[(2-methyl-1,3-benzoxazol-5-yl)amino]propan-1-one CAS Name: 1-(1-azepanyl)-2-[(2-methyl-1,3-benzoxazol-5-yl)amino]-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-[(2-methyl-1,3-benzoxazol-5-yl)amino]propan-1-one Traditional Name: 1-(azepan-1-yl)-2-[(2-methyl-1,3-benzoxazol-5-yl)amino]propan-1-one Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(C)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(C)C(=O)N3CCCCCC3

InChI

InChI=1S/C17H23N3O2/c1-12(17(21)20-9-5-3-4-6-10-20)18-14-7-8-16-15(11-14)19-13(2)22-16/h7-8,11-12,18H,3-6,9-10H2,1-2H3