4-[4,4-bis(2-methylphenyl)butylamino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one

Systemtic Name: 4-[4,4-bis(2-methylphenyl)butylamino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one Openeye Name: 4-[4,4-bis(o-tolyl)butylamino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one CAS Name: 4-[4,4-bis(2-methylphenyl)butylamino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one IUPAC Name: 4-[4,4-bis(2-methylphenyl)butylamino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one Traditional Name: 4-[4,4-bis(o-tolyl)butylamino]-4,5,6,7-tetrahydroindoxazen-3-one Formula: C25H30N2O2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCCNC2CCCC3=C2C(=O)NO3)C4=CC=CC=C4C

Isomeric SMILES

CC1=CC=CC=C1C(CCCNC2CCCC3=C2C(=O)NO3)C4=CC=CC=C4C

InChI

InChI=1S/C25H30N2O2/c1-17-9-3-5-11-19(17)21(20-12-6-4-10-18(20)2)13-8-16-26-22-14-7-15-23-24(22)25(28)27-29-23/h3-6,9-12,21-22,26H,7-8,13-16H2,1-2H3,(H,27,28)