[3-tert-butyl-8-(3-methylbutylamino)-8a-oxidanyl-2,3-dihydro-1,4-benzoxazin-5-yl]-phenyl-methanone

Systemtic Name: [3-tert-butyl-8-(3-methylbutylamino)-8a-oxidanyl-2,3-dihydro-1,4-benzoxazin-5-yl]-phenyl-methanone Openeye Name: [3-tert-butyl-8a-hydroxy-8-(isopentylamino)-2,3-dihydro-1,4-benzoxazin-5-yl]-phenyl-methanone CAS Name: [3-tert-butyl-8a-hydroxy-8-(3-methylbutylamino)-2,3-dihydro-1,4-benzoxazin-5-yl]-phenylmethanone IUPAC Name: [3-tert-butyl-8a-hydroxy-8-(3-methylbutylamino)-2,3-dihydro-1,4-benzoxazin-5-yl]-phenylmethanone Traditional Name: [3-tert-butyl-8a-hydroxy-8-(isoamylamino)-2,3-dihydro-1,4-benzoxazin-5-yl]-phenyl-methanone Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=CC=C(C2=NC(COC12O)C(C)(C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC1=CC=C(C2=NC(COC12O)C(C)(C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3/c1-16(2)13-14-25-19-12-11-18(21(27)17-9-7-6-8-10-17)22-24(19,28)29-15-20(26-22)23(3,4)5/h6-12,16,20,25,28H,13-15H2,1-5H3