6-methyl-8-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2,3-dihydro-1,4-benzoxazine-4-carboxylic acid

Systemtic Name: 6-methyl-8-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2,3-dihydro-1,4-benzoxazine-4-carboxylic acid Openeye Name: 8-(4-tert-butoxycarbonylpiperazin-1-yl)-6-methyl-2,3-dihydro-1,4-benzoxazine-4-carboxylic acid CAS Name: 6-methyl-8-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-2,3-dihydro-1,4-benzoxazine-4-carboxylic acid IUPAC Name: 6-methyl-8-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2,3-dihydro-1,4-benzoxazine-4-carboxylic acid Traditional Name: 8-(4-tert-butoxycarbonylpiperazino)-6-methyl-2,3-dihydro-1,4-benzoxazine-4-carboxylic acid Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)N3CCN(CC3)C(=O)OC(C)(C)C)OCCN2C(=O)O

Isomeric SMILES

CC1=CC2=C(C(=C1)N3CCN(CC3)C(=O)OC(C)(C)C)OCCN2C(=O)O

InChI

InChI=1S/C19H27N3O5/c1-13-11-14(16-15(12-13)22(17(23)24)9-10-26-16)20-5-7-21(8-6-20)18(25)27-19(2,3)4/h11-12H,5-10H2,1-4H3,(H,23,24)