[8-(3-methylbutylamino)-8a-oxidanyl-3,3-diphenyl-2H-1,4-benzoxazin-5-yl]-phenyl-methanone

Systemtic Name: [8-(3-methylbutylamino)-8a-oxidanyl-3,3-diphenyl-2H-1,4-benzoxazin-5-yl]-phenyl-methanone Openeye Name: [8a-hydroxy-8-(isopentylamino)-3,3-diphenyl-2H-1,4-benzoxazin-5-yl]-phenyl-methanone CAS Name: [8a-hydroxy-8-(3-methylbutylamino)-3,3-diphenyl-2H-1,4-benzoxazin-5-yl]-phenylmethanone IUPAC Name: [8a-hydroxy-8-(3-methylbutylamino)-3,3-diphenyl-2H-1,4-benzoxazin-5-yl]-phenylmethanone Traditional Name: [8a-hydroxy-8-(isoamylamino)-3,3-diphenyl-2H-1,4-benzoxazin-5-yl]-phenyl-methanone Formula: C32H32N2O3 MolecularWeight: 492.60808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=CC=C(C2=NC(COC12O)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)CCNC1=CC=C(C2=NC(COC12O)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H32N2O3/c1-23(2)20-21-33-28-19-18-27(29(35)24-12-6-3-7-13-24)30-32(28,36)37-22-31(34-30,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-19,23,33,36H,20-22H2,1-2H3